2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(4,6-dimethyl-2-pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(4,6-dimethylpyrimidin-2-yl)thio]-3-keto-butyronitrile Formula: C17H15N5OS MolecularWeight: 337.3989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C

InChI

InChI=1S/C17H15N5OS/c1-10-7-11(2)20-17(19-10)24-9-15(23)12(8-18)16-21-13-5-3-4-6-14(13)22-16/h3-7,21-22H,9H2,1-2H3