N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane

C109H103Cl2F3N10O21S6 — CID 159379211

IUPACN-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane
SMILESC.C.C.CC(C)Oc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ccncc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2ccccc2)cc1.O=C(c1ccccc1)c1cc(Cl)cnc1NS(=O)(=O)c1ccc(-c2ccco2)s1
InChIInChI=1S/C23H20F3NO4S.C21H19ClN2O3S.C21H19N3O6S.C21H20N2O4S.C20H13ClN2O4S2.3CH4/c1-15(2)31-18-9-11-19(12-10-18)32(29,30)27-21-13-8-17(23(24,25)26)14-20(21)22(28)16-6-4-3-5-7-16;1-14(2)15-8-10-18(11-9-15)28(26,27)24-21-19(12-17(22)13-23-21)20(25)16-6-4-3-5-7-16;1-14(2)30-17-8-10-18(11-9-17)31(28,29)23-21-19(12-16(13-22-21)24(26)27)20(25)15-6-4-3-5-7-15;1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-12-13-22-14-19(20)21(24)16-6-4-3-5-7-16;21-14-11-15(19(24)13-5-2-1-3-6-13)20(22-12-14)23-29(25,26)18-9-8-17(28-18)16-7-4-10-27-16;;;/h3-15,27H,1-2H3;3-14H,1-2H3,(H,23,24);3-14H,1-2H3,(H,22,23);3-15H,1-2H3,(H,22,23);1-12H,(H,22,23);3*1H4
InChIKeyLKRPMYQKEDCAOB-UHFFFAOYSA-N
MW2209.37 g/mol
LogP25.12
Rot. Bonds34

About N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane

N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane (PubChem CID 159379211) has the molecular formula C109H103Cl2F3N10O21S6 and a molecular weight of 2209.37 g/mol. Its IUPAC name is N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane.

Molecular Properties

Compound NameN-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane
PubChem CID159379211
Molecular FormulaC109H103Cl2F3N10O21S6
Molecular Weight2209.37 g/mol
Exact Mass2206.50
IUPAC NameN-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane
SMILESC.C.C.CC(C)Oc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ccncc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2ccccc2)cc1.O=C(c1ccccc1)c1cc(Cl)cnc1NS(=O)(=O)c1ccc(-c2ccco2)s1
InChIInChI=1S/C23H20F3NO4S.C21H19ClN2O3S.C21H19N3O6S.C21H20N2O4S.C20H13ClN2O4S2.3CH4/c1-15(2)31-18-9-11-19(12-10-18)32(29,30)27-21-13-8-17(23(24,25)26)14-20(21)22(28)16-6-4-3-5-7-16;1-14(2)15-8-10-18(11-9-15)28(26,27)24-21-19(12-17(22)13-23-21)20(25)16-6-4-3-5-7-16;1-14(2)30-17-8-10-18(11-9-17)31(28,29)23-21-19(12-16(13-22-21)24(26)27)20(25)15-6-4-3-5-7-15;1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-12-13-22-14-19(20)21(24)16-6-4-3-5-7-16;21-14-11-15(19(24)13-5-2-1-3-6-13)20(22-12-14)23-29(25,26)18-9-8-17(28-18)16-7-4-10-27-16;;;/h3-15,27H,1-2H3;3-14H,1-2H3,(H,23,24);3-14H,1-2H3,(H,22,23);3-15H,1-2H3,(H,22,23);1-12H,(H,22,23);3*1H4
InChIKeyLKRPMYQKEDCAOB-UHFFFAOYSA-N
XLogP25.12
TPSA451.73 Ų
H-Bond Donors5
H-Bond Acceptors26
Rotatable Bonds34
Heavy Atoms151
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002209.37
LogP ≤ 525.12
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane?
The IUPAC name of N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane (CID 159379211) is N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane.
What is the SMILES notation for N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane?
The canonical SMILES for N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane is C.C.C.CC(C)Oc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ccncc2C(=O)c2ccccc2)cc1.CC(C)Oc1ccc(S(=O)(=O)Nc2ncc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1.CC(C)c1ccc(S(=O)(=O)Nc2ncc(Cl)cc2C(=O)c2ccccc2)cc1.O=C(c1ccccc1)c1cc(Cl)cnc1NS(=O)(=O)c1ccc(-c2ccco2)s1.
What is the InChIKey of N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane?
The InChIKey is LKRPMYQKEDCAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F3NO4S.C21H19ClN2O3S.C21H19N3O6S.C21H20N2O4S.C20H13ClN2O4S2.3CH4/c1-15(2)31-18-9-11-19(12-10-18)32(29,30)27-21-13-8-17(23(24,25)26)14-20(21)22(28)16-6-4-3-5-7-16;1-14(2)15-8-10-18(11-9-15)28(26,27)24-21-19(12-17(22)13-23-21)20(25)16-6-4-3-5-7-16;1-14(2)30-17-8-10-18(11-9-17)31(28,29)23-21-19(12-16(13-22-21)24(26)27)20(25)15-6-4-3-5-7-15;1-15(2)27-17-8-10-18(11-9-17)28(25,26)23-20-12-13-22-14-19(20)21(24)16-6-4-3-5-7-16;21-14-11-15(19(24)13-5-2-1-3-6-13)20(22-12-14)23-29(25,26)18-9-8-17(28-18)16-7-4-10-27-16;;;/h3-15,27H,1-2H3;3-14H,1-2H3,(H,23,24);3-14H,1-2H3,(H,22,23);3-15H,1-2H3,(H,22,23);1-12H,(H,22,23);3*1H4.
What are the key properties of N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane?
N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane has a molecular weight of 2209.37 g/mol, XLogP of 25.12, 34 rotatable bonds, 5 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzoyl-5-chloro-2-pyridinyl)-5-(furan-2-yl)thiophene-2-sulfonamide;N-(3-benzoyl-5-chloro-2-pyridinyl)-4-propan-2-ylbenzenesulfonamide;N-(3-benzoyl-5-nitro-2-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-(3-benzoyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide;N-[2-benzoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yloxybenzenesulfonamide;methane is sourced from PubChem (CID 159379211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).