2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]butyronitrile Formula: C24H21N5OS MolecularWeight: 427.52144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C(=C3N(C4=CC=CC=C4N3C)C)C#N

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C(=C3N(C4=CC=CC=C4N3C)C)C#N

InChI

InChI=1S/C24H21N5OS/c1-16-13-19(17-9-5-4-6-10-17)27-24(26-16)31-15-22(30)18(14-25)23-28(2)20-11-7-8-12-21(20)29(23)3/h4-13H,15H2,1-3H3