2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-methylphenyl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-methylphenyl)-4-methylsulfanyl-butanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanyl-N-(p-tolyl)butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-methylphenyl)-4-(methylthio)butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-methylphenyl)-4-methylsulfanylbutanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)-N-(p-tolyl)butyramide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(CCSC)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(CCSC)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H21N3O3S2/c1-13-7-9-14(10-8-13)20-19(23)16(11-12-26-2)21-18-15-5-3-4-6-17(15)27(24,25)22-18/h3-10,16H,11-12H2,1-2H3,(H,20,23)(H,21,22)