N-(4-methoxyphenyl)-3-[[[4-(methylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-[[[4-(methylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-3-[[[4-(methylsulfanylmethyl)benzoyl]amino]carbamoyl]benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-3-[[[[4-[(methylthio)methyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-[[[4-(methylsulfanylmethyl)benzoyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N-(4-methoxyphenyl)-3-[[[4-[(methylthio)methyl]benzoyl]amino]carbamoyl]benzenesulfonamide Formula: C23H23N3O5S2 MolecularWeight: 485.57582

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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)C3=CC=C(C=C3)CSC

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O5S2/c1-31-20-12-10-19(11-13-20)26-33(29,30)21-5-3-4-18(14-21)23(28)25-24-22(27)17-8-6-16(7-9-17)15-32-2/h3-14,26H,15H2,1-2H3,(H,24,27)(H,25,28)