2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-oxidopyridin-1-ium-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-[(1-oxido-2-pyridin-1-iumyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-oxidopyridin-1-ium-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-[(1-oxidopyridin-1-ium-2-yl)thio]butyronitrile Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=CC=CC=[N+]3[O-])C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=CC=CC=[N+]3[O-])C

InChI

InChI=1S/C18H16N4O2S/c1-20-14-7-3-4-8-15(14)21(2)18(20)13(11-19)16(23)12-25-17-9-5-6-10-22(17)24/h3-10H,12H2,1-2H3