2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-4-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-4-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxo-4-[5-oxo-4-(2-thienyl)tetrazol-1-yl]butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-3-oxo-4-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)butanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxo-4-(5-oxo-4-thiophen-2-yltetrazol-1-yl)butanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-[5-keto-4-(2-thienyl)tetrazol-1-yl]butyronitrile Formula: C18H15N7O2S MolecularWeight: 393.4224

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CN3C(=O)N(N=N3)C4=CC=CS4)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CN3C(=O)N(N=N3)C4=CC=CS4)C

InChI

InChI=1S/C18H15N7O2S/c1-22-13-6-3-4-7-14(13)23(2)17(22)12(10-19)15(26)11-24-18(27)25(21-20-24)16-8-5-9-28-16/h3-9H,11H2,1-2H3