N-(2-methyl-1,3-benzothiazol-5-yl)-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-(p-tolylthio)butyramide Formula: C19H20N2OS2 MolecularWeight: 356.5049

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)SC(=N3)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)SC(=N3)C

InChI

InChI=1S/C19H20N2OS2/c1-13-5-8-16(9-6-13)23-11-3-4-19(22)21-15-7-10-18-17(12-15)20-14(2)24-18/h5-10,12H,3-4,11H2,1-2H3,(H,21,22)