N-(4-methoxyphenyl)-3-[(4-phenylsulfanylbutanoylamino)carbamoyl]benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-[(4-phenylsulfanylbutanoylamino)carbamoyl]benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-3-[(4-phenylsulfanylbutanoylamino)carbamoyl]benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-3-[oxo-[[1-oxo-4-(phenylthio)butyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-[(4-phenylsulfanylbutanoylamino)carbamoyl]benzenesulfonamide Traditional Name: N-(4-methoxyphenyl)-3-[[4-(phenylthio)butanoylamino]carbamoyl]benzenesulfonamide Formula: C24H25N3O5S2 MolecularWeight: 499.6024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C24H25N3O5S2/c1-32-20-14-12-19(13-15-20)27-34(30,31)22-10-5-7-18(17-22)24(29)26-25-23(28)11-6-16-33-21-8-3-2-4-9-21/h2-5,7-10,12-15,17,27H,6,11,16H2,1H3,(H,25,28)(H,26,29)