3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide

C119H113F9N6O29S5 — CID 158315962

IUPAC3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
SMILESCOc1cc(/C=C\c2cccc(NS(=O)(=O)c3ccc(C(F)(F)F)cc3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3ccc(OC(F)(F)F)cc3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(C(F)(F)F)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)c2)cc(OC)c1OC.COc1cccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)c1
InChIInChI=1S/C24H22F3NO6S.2C24H22F3NO5S.C24H25NO6S.C23H22N2O7S/c1-31-21-14-17(15-22(32-2)23(21)33-3)8-7-16-5-4-6-18(13-16)28-35(29,30)20-11-9-19(10-12-20)34-24(25,26)27;1-31-21-13-17(14-22(32-2)23(21)33-3)11-10-16-6-4-8-19(12-16)28-34(29,30)20-9-5-7-18(15-20)24(25,26)27;1-31-21-14-17(15-22(32-2)23(21)33-3)8-7-16-5-4-6-19(13-16)28-34(29,30)20-11-9-18(10-12-20)24(25,26)27;1-28-20-9-6-10-21(16-20)32(26,27)25-19-8-5-7-17(13-19)11-12-18-14-22(29-2)24(31-4)23(15-18)30-3;1-30-21-13-17(14-22(31-2)23(21)32-3)11-10-16-6-4-7-18(12-16)24-33(28,29)20-9-5-8-19(15-20)25(26)27/h4-15,28H,1-3H3;2*4-15,28H,1-3H3;5-16,25H,1-4H3;4-15,24H,1-3H3/b8-7-;11-10-;8-7-;12-11-;11-10-
InChIKeyGOGLKEUVSJZXDP-SDTSZWQESA-N
MW2422.54 g/mol
LogP26.27
Rot. Bonds43

About 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide

3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide (PubChem CID 158315962) has the molecular formula C119H113F9N6O29S5 and a molecular weight of 2422.54 g/mol. Its IUPAC name is 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide.

Molecular Properties

Compound Name3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
PubChem CID158315962
Molecular FormulaC119H113F9N6O29S5
Molecular Weight2422.54 g/mol
Exact Mass2420.60
IUPAC Name3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
SMILESCOc1cc(/C=C\c2cccc(NS(=O)(=O)c3ccc(C(F)(F)F)cc3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3ccc(OC(F)(F)F)cc3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(C(F)(F)F)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)c2)cc(OC)c1OC.COc1cccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)c1
InChIInChI=1S/C24H22F3NO6S.2C24H22F3NO5S.C24H25NO6S.C23H22N2O7S/c1-31-21-14-17(15-22(32-2)23(21)33-3)8-7-16-5-4-6-18(13-16)28-35(29,30)20-11-9-19(10-12-20)34-24(25,26)27;1-31-21-13-17(14-22(32-2)23(21)33-3)11-10-16-6-4-8-19(12-16)28-34(29,30)20-9-5-7-18(15-20)24(25,26)27;1-31-21-14-17(15-22(32-2)23(21)33-3)8-7-16-5-4-6-19(13-16)28-34(29,30)20-11-9-18(10-12-20)24(25,26)27;1-28-20-9-6-10-21(16-20)32(26,27)25-19-8-5-7-17(13-19)11-12-18-14-22(29-2)24(31-4)23(15-18)30-3;1-30-21-13-17(14-22(31-2)23(21)32-3)11-10-16-6-4-7-18(12-16)24-33(28,29)20-9-5-8-19(15-20)25(26)27/h4-15,28H,1-3H3;2*4-15,28H,1-3H3;5-16,25H,1-4H3;4-15,24H,1-3H3/b8-7-;11-10-;8-7-;12-11-;11-10-
InChIKeyGOGLKEUVSJZXDP-SDTSZWQESA-N
XLogP26.27
TPSA430.90 Ų
H-Bond Donors5
H-Bond Acceptors29
Rotatable Bonds43
Heavy Atoms168
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002422.54
LogP ≤ 526.27
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide with MolForge

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Related Compounds

4-amino-N-[2,3-dimethoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;N-[2,3-dimethoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]-3-methoxybenzenesulfonamide;N-[2,3-dimethoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]-4-(trifluoromethoxy)benzenesulfonamide;N-[2,3-dimethoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;N-[2,3-dimethoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]-4-(trifluoromethyl)benzenesulfonamide
CID 157140642
3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
CID 121315059
4-methoxy-3-nitro-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
CID 7938669
3-chloro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide
CID 121314914
2-methoxy-5-nitro-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
CID 8822400
N-(2,5-dimethoxyphenyl)-3-nitrobenzenesulfonamide
CID 2885763
N-[3-hydroxy-2-methoxy-6-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide
CID 121314999
2-methoxy-4-nitro-N-[4-(trifluoromethoxy)phenyl]benzenesulfonamide
CID 47062695
N-[4-(trifluoromethyl)phenyl]sulfanyl-3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]aniline
CID 145072366
N-(3,4-dimethoxyphenyl)-4-(trifluoromethoxy)benzenesulfonamide
CID 3863930
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
3-nitro-N-[3-(3,4,5-trimethoxyanilino)quinoxalin-2-yl]benzenesulfonamide
CID 3333042

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?
The IUPAC name of 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide (CID 158315962) is 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide.
What is the SMILES notation for 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?
The canonical SMILES for 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide is COc1cc(/C=C\c2cccc(NS(=O)(=O)c3ccc(C(F)(F)F)cc3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3ccc(OC(F)(F)F)cc3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc(C(F)(F)F)c3)c2)cc(OC)c1OC.COc1cc(/C=C\c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)c2)cc(OC)c1OC.COc1cccc(S(=O)(=O)Nc2cccc(/C=C\c3cc(OC)c(OC)c(OC)c3)c2)c1.
What is the InChIKey of 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?
The InChIKey is GOGLKEUVSJZXDP-SDTSZWQESA-N. The full InChI is InChI=1S/C24H22F3NO6S.2C24H22F3NO5S.C24H25NO6S.C23H22N2O7S/c1-31-21-14-17(15-22(32-2)23(21)33-3)8-7-16-5-4-6-18(13-16)28-35(29,30)20-11-9-19(10-12-20)34-24(25,26)27;1-31-21-13-17(14-22(32-2)23(21)33-3)11-10-16-6-4-8-19(12-16)28-34(29,30)20-9-5-7-18(15-20)24(25,26)27;1-31-21-14-17(15-22(32-2)23(21)33-3)8-7-16-5-4-6-19(13-16)28-34(29,30)20-11-9-18(10-12-20)24(25,26)27;1-28-20-9-6-10-21(16-20)32(26,27)25-19-8-5-7-17(13-19)11-12-18-14-22(29-2)24(31-4)23(15-18)30-3;1-30-21-13-17(14-22(31-2)23(21)32-3)11-10-16-6-4-7-18(12-16)24-33(28,29)20-9-5-8-19(15-20)25(26)27/h4-15,28H,1-3H3;2*4-15,28H,1-3H3;5-16,25H,1-4H3;4-15,24H,1-3H3/b8-7-;11-10-;8-7-;12-11-;11-10-.
What are the key properties of 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide?
3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide has a molecular weight of 2422.54 g/mol, XLogP of 26.27, 43 rotatable bonds, 5 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-nitro-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethoxy)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;3-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide;4-(trifluoromethyl)-N-[3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]benzenesulfonamide is sourced from PubChem (CID 158315962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).