2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-(5-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(5-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-(4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)butyronitrile Formula: C26H21N5O2S MolecularWeight: 467.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C(=C3N(C4=CC=CC=C4N3C)C)C#N)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C(=C3N(C4=CC=CC=C4N3C)C)C#N)C5=CC=CC=C5

InChI

InChI=1S/C26H21N5O2S/c1-16-22-24(34-23(16)17-9-5-4-6-10-17)28-15-31(26(22)33)14-21(32)18(13-27)25-29(2)19-11-7-8-12-20(19)30(25)3/h4-12,15H,14H2,1-3H3