3-[[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]carbamoyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[(2-methyl-5-methylsulfanyl-benzoyl)amino]carbamoyl]benzenesulfonamide CAS Name: 3-[[[[2-methyl-5-(methylthio)phenyl]-oxomethyl]hydrazo]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[(2-methyl-5-methylsulfanylbenzoyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-3-[[[2-methyl-5-(methylthio)benzoyl]amino]carbamoyl]benzenesulfonamide Formula: C23H23N3O4S2 MolecularWeight: 469.57642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H23N3O4S2/c1-16-11-12-19(31-2)14-21(16)23(28)26-25-22(27)18-9-6-10-20(13-18)32(29,30)24-15-17-7-4-3-5-8-17/h3-14,24H,15H2,1-2H3,(H,25,27)(H,26,28)