N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-(p-tolylthio)butyramide Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)C)N2C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)C)N2C

InChI

InChI=1S/C21H24N2O2S2/c1-4-25-17-7-5-8-18-20(17)23(3)21(27-18)22-19(24)9-6-14-26-16-12-10-15(2)11-13-16/h5,7-8,10-13H,4,6,9,14H2,1-3H3