2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide

C66H56BrCl6N15O3S3Sn — CID 161202392

About 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide

2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide (PubChem CID 161202392) has the molecular formula C66H56BrCl6N15O3S3Sn and a molecular weight of 1614.81 g/mol. Its IUPAC name is 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide.

Molecular Properties

• Compound Name: 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide
• PubChem CID: 161202392
• Molecular Formula: C66H56BrCl6N15O3S3Sn
• Molecular Weight: 1614.81 g/mol
• Exact Mass: 1611.02
• IUPAC Name: 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide
• SMILES: C=CCn1ccnc1-c1sc(-c2ccnc(NC(C)=O)c2)nc1-c1ccc(Cl)cc1Cl.C=CCn1ccnc1-c1sc(Br)nc1-c1ccc(Cl)cc1Cl.CC(=O)Nc1cc(-c2nc(-c3ccc(Cl)cc3Cl)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc([Sn](C)(C)C)ccn1
• InChI: InChI=1S/C22H17Cl2N5OS.C19H13Cl2N5OS.C15H10BrCl2N3S.C7H7N2O.3CH3.Sn/c1-3-9-29-10-8-26-21(29)20-19(16-5-4-15(23)12-17(16)24)28-22(31-20)14-6-7-25-18(11-14)27-13(2)30;1-10(27)25-15-8-11(4-5-22-15)19-26-16(13-3-2-12(20)9-14(13)21)17(28-19)18-23-6-7-24-18;1-2-6-21-7-5-19-14(21)13-12(20-15(16)22-13)10-4-3-9(17)8-11(10)18;1-6(10)9-7-4-2-3-5-8-7;;;;/h3-8,10-12H,1,9H2,2H3,(H,25,27,30);2-9H,1H3,(H,23,24)(H,22,25,27);2-5,7-8H,1,6H2;3-5H,1H3,(H,8,9,10);3*1H3
• InChIKey: UVDQSKCKWGVPEY-UHFFFAOYSA-N
• XLogP: 19.23
• TPSA: 228.96 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 17
• Rotatable Bonds: 16
• Heavy Atoms: 95
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1614.81
LogP ≤ 5	19.23
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide?

The IUPAC name of 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide (CID 161202392) is 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide.

What is the SMILES notation for 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide?

The canonical SMILES for 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide is C=CCn1ccnc1-c1sc(-c2ccnc(NC(C)=O)c2)nc1-c1ccc(Cl)cc1Cl.C=CCn1ccnc1-c1sc(Br)nc1-c1ccc(Cl)cc1Cl.CC(=O)Nc1cc(-c2nc(-c3ccc(Cl)cc3Cl)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc([Sn](C)(C)C)ccn1.

What is the InChIKey of 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide?

The InChIKey is UVDQSKCKWGVPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17Cl2N5OS.C19H13Cl2N5OS.C15H10BrCl2N3S.C7H7N2O.3CH3.Sn/c1-3-9-29-10-8-26-21(29)20-19(16-5-4-15(23)12-17(16)24)28-22(31-20)14-6-7-25-18(11-14)27-13(2)30;1-10(27)25-15-8-11(4-5-22-15)19-26-16(13-3-2-12(20)9-14(13)21)17(28-19)18-23-6-7-24-18;1-2-6-21-7-5-19-14(21)13-12(20-15(16)22-13)10-4-3-9(17)8-11(10)18;1-6(10)9-7-4-2-3-5-8-7;;;;/h3-8,10-12H,1,9H2,2H3,(H,25,27,30);2-9H,1H3,(H,23,24)(H,22,25,27);2-5,7-8H,1,6H2;3-5H,1H3,(H,8,9,10);3*1H3;.

What are the key properties of 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide?

2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide has a molecular weight of 1614.81 g/mol, XLogP of 19.23, 16 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide is sourced from PubChem (CID 161202392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).