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

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methylsulfanyl-N-(4-methylsulfanylphenyl)butanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanyl-N-(4-methylsulfanylphenyl)butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)-N-[4-(methylthio)phenyl]butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanyl-N-(4-methylsulfanylphenyl)butanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)-N-[4-(methylthio)phenyl]butyramide Formula: C19H21N3O3S3 MolecularWeight: 435.58334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O3S3/c1-26-12-11-16(19(23)20-13-7-9-14(27-2)10-8-13)21-18-15-5-3-4-6-17(15)28(24,25)22-18/h3-10,16H,11-12H2,1-2H3,(H,20,23)(H,21,22)