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

Systemtic Name: 3-[[[4-(methylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[[4-(methylsulfanylmethyl)benzoyl]amino]carbamoyl]benzenesulfonamide CAS Name: 3-[[[[4-[(methylthio)methyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[[4-(methylsulfanylmethyl)benzoyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[[4-[(methylthio)methyl]benzoyl]amino]carbamoyl]benzenesulfonamide Formula: C23H23N3O4S2 MolecularWeight: 469.57642

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H23N3O4S2/c1-31-16-18-10-12-19(13-11-18)22(27)25-26-23(28)20-8-5-9-21(14-20)32(29,30)24-15-17-6-3-2-4-7-17/h2-14,24H,15-16H2,1H3,(H,25,27)(H,26,28)