(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-3-oxo-pentanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]-3-oxopentanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-3-oxopentanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-[(4-methoxyphenyl)thio]valeronitrile Formula: C19H16N2O2S2 MolecularWeight: 368.47254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(=C1NC2=CC=CC=C2S1)C#N)SC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)/C(=C/1\NC2=CC=CC=C2S1)/C#N)SC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H16N2O2S2/c1-12(24-14-9-7-13(23-2)8-10-14)18(22)15(11-20)19-21-16-5-3-4-6-17(16)25-19/h3-10,12,21H,1-2H3/b19-15+