N-(1,3-benzothiazol-6-yl)-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-6-yl)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(1,3-benzothiazol-6-yl)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(1,3-benzothiazol-6-yl)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(1,3-benzothiazol-6-yl)-4-(p-tolylthio)butyramide Formula: C18H18N2OS2 MolecularWeight: 342.47832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C18H18N2OS2/c1-13-4-7-15(8-5-13)22-10-2-3-18(21)20-14-6-9-16-17(11-14)23-12-19-16/h4-9,11-12H,2-3,10H2,1H3,(H,20,21)