N-(3-ethyl-4-methoxy-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)C)OC

Isomeric SMILES

CCN1C2=C(C=CC=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)C)OC

InChI

InChI=1S/C21H24N2O2S2/c1-4-23-20-17(25-3)7-5-8-18(20)27-21(23)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