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

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-(p-tolylthio)butyramide Formula: C19H19ClN2OS2 MolecularWeight: 390.94996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=NC3=C(S2)C=CC(=C3C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=NC3=C(S2)C=CC(=C3C)Cl

InChI

InChI=1S/C19H19ClN2OS2/c1-12-5-7-14(8-6-12)24-11-3-4-17(23)21-19-22-18-13(2)15(20)9-10-16(18)25-19/h5-10H,3-4,11H2,1-2H3,(H,21,22,23)