2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-N-(3-methylsulfanylphenyl)butanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-N-(3-methylsulfanylphenyl)butanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-(3-methylsulfanylphenyl)butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-[3-(methylthio)phenyl]butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-(3-methylsulfanylphenyl)butanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-N-[3-(methylthio)phenyl]butyramide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=CC=C1)SC)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)C(C(=O)NC1=CC(=CC=C1)SC)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H21N3O3S2/c1-12(2)17(19(23)20-13-7-6-8-14(11-13)26-3)21-18-15-9-4-5-10-16(15)27(24,25)22-18/h4-12,17H,1-3H3,(H,20,23)(H,21,22)