(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-(1-phenylimidazol-2-yl)sulfanyl-butanenitrile

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-(1-phenylimidazol-2-yl)sulfanyl-butanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1-phenylimidazol-2-yl)sulfanyl-butanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-[(1-phenyl-2-imidazolyl)thio]butanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1-phenylimidazol-2-yl)sulfanylbutanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-[(1-phenylimidazol-2-yl)thio]butyronitrile Formula: C20H14N4OS2 MolecularWeight: 390.48136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=CN=C2SCC(=O)C(=C3NC4=CC=CC=C4S3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=CN=C2SCC(=O)/C(=C/3\NC4=CC=CC=C4S3)/C#N

InChI

InChI=1S/C20H14N4OS2/c21-12-15(19-23-16-8-4-5-9-18(16)27-19)17(25)13-26-20-22-10-11-24(20)14-6-2-1-3-7-14/h1-11,23H,13H2/b19-15+