3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide

C121H126F2N6O28S5 — CID 162008014

About 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide

3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide (PubChem CID 162008014) has the molecular formula C121H126F2N6O28S5 and a molecular weight of 2310.68 g/mol. Its IUPAC name is 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide.

Molecular Properties

• Compound Name: 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
• PubChem CID: 162008014
• Molecular Formula: C121H126F2N6O28S5
• Molecular Weight: 2310.68 g/mol
• Exact Mass: 2308.72
• IUPAC Name: 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
• SMILES: COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(C(C)(C)C)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(F)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(N)c3)c2)cc(OC)c1OC.COc1ccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)cc1F.COc1ccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)cc1O
• InChI: InChI=1S/C27H31NO5S.C24H24FNO6S.C24H25NO7S.C23H22FNO5S.C23H24N2O5S/c1-27(2,3)21-10-8-12-23(18-21)34(29,30)28-22-11-7-9-19(15-22)13-14-20-16-24(31-4)26(33-6)25(17-20)32-5;1-29-21-11-10-19(15-20(21)25)33(27,28)26-18-7-5-6-16(12-18)8-9-17-13-22(30-2)24(32-4)23(14-17)31-3;1-29-21-11-10-19(15-20(21)26)33(27,28)25-18-7-5-6-16(12-18)8-9-17-13-22(30-2)24(32-4)23(14-17)31-3;2*1-28-21-13-17(14-22(29-2)23(21)30-3)11-10-16-6-4-8-19(12-16)25-31(26,27)20-9-5-7-18(24)15-20/h7-18,28H,1-6H3;5-15,26H,1-4H3;5-15,25-26H,1-4H3;4-15,25H,1-3H3;4-15,25H,24H2,1-3H3/b14-13-;2*9-8-;2*11-10-
• InChIKey: YTCDZRLSARHBBJ-CIZNEQRVSA-N
• XLogP: 24.30
• TPSA: 434.01 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 42
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2310.68
LogP ≤ 5	24.30
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?

The IUPAC name of 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide (CID 162008014) is 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide.

What is the SMILES notation for 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?

The canonical SMILES for 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide is COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(C(C)(C)C)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(F)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(N)c3)c2)cc(OC)c1OC.COc1ccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)cc1F.COc1ccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)cc1O.

What is the InChIKey of 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?

The InChIKey is YTCDZRLSARHBBJ-CIZNEQRVSA-N. The full InChI is InChI=1S/C27H31NO5S.C24H24FNO6S.C24H25NO7S.C23H22FNO5S.C23H24N2O5S/c1-27(2,3)21-10-8-12-23(18-21)34(29,30)28-22-11-7-9-19(15-22)13-14-20-16-24(31-4)26(33-6)25(17-20)32-5;1-29-21-11-10-19(15-20(21)25)33(27,28)26-18-7-5-6-16(12-18)8-9-17-13-22(30-2)24(32-4)23(14-17)31-3;1-29-21-11-10-19(15-20(21)26)33(27,28)25-18-7-5-6-16(12-18)8-9-17-13-22(30-2)24(32-4)23(14-17)31-3;2*1-28-21-13-17(14-22(29-2)23(21)30-3)11-10-16-6-4-8-19(12-16)25-31(26,27)20-9-5-7-18(24)15-20/h7-18,28H,1-6H3;5-15,26H,1-4H3;5-15,25-26H,1-4H3;4-15,25H,1-3H3;4-15,25H,24H2,1-3H3/b14-13-;2*9-8-;2*11-10-.

What are the key properties of 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?

3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide has a molecular weight of 2310.68 g/mol, XLogP of 24.30, 42 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-tert-butyl-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-fluoro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-hydroxy-4-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide is sourced from PubChem (CID 162008014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).