bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane

C115H105Cl5F5N25O9S56 — CID 167591997

About bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane

bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane (PubChem CID 167591997) has the molecular formula C115H105Cl5F5N25O9S56 and a molecular weight of 4049.28 g/mol. Its IUPAC name is bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane.

Molecular Properties

• Compound Name: bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane
• PubChem CID: 167591997
• Molecular Formula: C115H105Cl5F5N25O9S56
• Molecular Weight: 4049.28 g/mol
• Exact Mass: 4040.12
• IUPAC Name: bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane
• SMILES: C.C=CC(=O)Nc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1C#C[C@]1(C)CCN(C)C1.C=CC(=O)O.CC1(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2[N+](=O)[O-])CCNC1.CN1CC[C@@](C)(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2N)C1.CN1CC[C@@](C)(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2[N+](=O)[O-])C1.C[C@@]1(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2[N+](=O)[O-])CCNC1.S=S=S=S=S=S=S=S.S=S=S=S=S=S=S=S=S=S=S=S=S=S=S.S=S=S=S=S=S=S=S=S=S=S=S=S=S=S=S.S=S=S=S=S=S=S=S=S=S=S=S=S=S=S=S=S
• InChI: InChI=1S/C25H23ClFN5O.C22H19ClFN5O2.C22H21ClFN5.2C21H17ClFN5O2.C3H4O2.CH4.S17.S16.S15.S8/c1-4-22(33)30-20-13-17-21(12-16(20)8-9-25(2)10-11-32(3)14-25)28-15-29-24(17)31-19-7-5-6-18(26)23(19)27;1-22(8-9-28(2)12-22)7-6-14-10-18-15(11-19(14)29(30)31)21(26-13-25-18)27-17-5-3-4-16(23)20(17)24;1-22(8-9-29(2)12-22)7-6-14-10-19-15(11-17(14)25)21(27-13-26-19)28-18-5-3-4-16(23)20(18)24;2*1-21(7-8-24-11-21)6-5-13-9-17-14(10-18(13)28(29)30)20(26-12-25-17)27-16-4-2-3-15(22)19(16)23;1-2-3(4)5;;1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-14-12-10-8-6-4-2;1-3-5-7-8-6-4-2/h4-7,12-13,15H,1,10-11,14H2,2-3H3,(H,30,33)(H,28,29,31);3-5,10-11,13H,8-9,12H2,1-2H3,(H,25,26,27);3-5,10-11,13H,8-9,12,25H2,1-2H3,(H,26,27,28);2*2-4,9-10,12,24H,7-8,11H2,1H3,(H,25,26,27);2H,1H2,(H,4,5);1H4;;;;/t25-;2*22-;21-;;;;;;;/m1111......./s1
• InChIKey: IOBLLABPNUFYAM-CUXCYJIYSA-N
• XLogP: 23.80
• TPSA: 444.67 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 37
• Rotatable Bonds: 16
• Heavy Atoms: 215
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4049.28
LogP ≤ 5	23.80
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?

The IUPAC name of bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane (CID 167591997) is bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane.

What is the SMILES notation for bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?

The canonical SMILES for bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane is C.C=CC(=O)Nc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1C#C[C@]1(C)CCN(C)C1.C=CC(=O)O.CC1(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2[N+](=O)[O-])CCNC1.CN1CC[C@@](C)(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2N)C1.CN1CC[C@@](C)(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2[N+](=O)[O-])C1.C[C@@]1(C#Cc2cc3ncnc(Nc4cccc(Cl)c4F)c3cc2[N+](=O)[O-])CCNC1.S=S=S=S=S=S=S=S.S=S=S=S=S=S=S=S=S=S=S=S=S=S=S.S=S=S=S=S=S=S=S=S=S=S=S=S=S=S=S.S=S=S=S=S=S=S=S=S=S=S=S=S=S=S=S=S.

What is the InChIKey of bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?

The InChIKey is IOBLLABPNUFYAM-CUXCYJIYSA-N. The full InChI is InChI=1S/C25H23ClFN5O.C22H19ClFN5O2.C22H21ClFN5.2C21H17ClFN5O2.C3H4O2.CH4.S17.S16.S15.S8/c1-4-22(33)30-20-13-17-21(12-16(20)8-9-25(2)10-11-32(3)14-25)28-15-29-24(17)31-19-7-5-6-18(26)23(19)27;1-22(8-9-28(2)12-22)7-6-14-10-18-15(11-19(14)29(30)31)21(26-13-25-18)27-17-5-3-4-16(23)20(17)24;1-22(8-9-29(2)12-22)7-6-14-10-19-15(11-17(14)25)21(27-13-26-19)28-18-5-3-4-16(23)20(18)24;2*1-21(7-8-24-11-21)6-5-13-9-17-14(10-18(13)28(29)30)20(26-12-25-17)27-16-4-2-3-15(22)19(16)23;1-2-3(4)5;;1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-14-12-10-8-6-4-2;1-3-5-7-8-6-4-2/h4-7,12-13,15H,1,10-11,14H2,2-3H3,(H,30,33)(H,28,29,31);3-5,10-11,13H,8-9,12H2,1-2H3,(H,25,26,27);3-5,10-11,13H,8-9,12,25H2,1-2H3,(H,26,27,28);2*2-4,9-10,12,24H,7-8,11H2,1H3,(H,25,26,27);2H,1H2,(H,4,5);1H4;;;;/t25-;2*22-;21-;;;;;;;/m1111......./s1.

What are the key properties of bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane?

bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane has a molecular weight of 4049.28 g/mol, XLogP of 23.80, 16 rotatable bonds, 10 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for bis[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;bis[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;N-[4-(3-chloro-2-fluoroanilino)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazolin-6-yl]prop-2-enamide;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;4-N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-1,3-dimethylpyrrolidin-3-yl]ethynyl]quinazoline-4,6-diamine;N-(3-chloro-2-fluorophenyl)-7-[2-[(3S)-3-methylpyrrolidin-3-yl]ethynyl]-6-nitroquinazolin-4-amine;N-(3-chloro-2-fluorophenyl)-7-[2-(3-methylpyrrolidin-3-yl)ethynyl]-6-nitroquinazolin-4-amine;methane;prop-2-enoic acid;sulfanylidene-[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane;sulfanylidene-[[[[[[[[[[[[(sulfanylidene-λ4-sulfanylidene)-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfanylidene]-λ4-sulfane is sourced from PubChem (CID 167591997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).