2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-phenethyl-butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-phenethyl-butanamide Openeye Name: 4-methylsulfanyl-N-phenethyl-2-(p-tolylsulfonylamino)butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-phenethylbutanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-phenethylbutanamide Traditional Name: 4-(methylthio)-N-phenethyl-2-(tosylamino)butyramide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O3S2/c1-16-8-10-18(11-9-16)27(24,25)22-19(13-15-26-2)20(23)21-14-12-17-6-4-3-5-7-17/h3-11,19,22H,12-15H2,1-2H3,(H,21,23)