(2S)-3-(2-chlorophenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: (2S)-3-(2-chlorophenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: (2S)-3-(2-chlorophenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxo-propanenitrile CAS Name: (2S)-3-(2-chlorophenyl)-2-(1-methyl-2-benzimidazolyl)-3-oxopropanenitrile IUPAC Name: (2S)-3-(2-chlorophenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxopropanenitrile Traditional Name: (2S)-3-(2-chlorophenyl)-3-keto-2-(1-methylbenzimidazol-2-yl)propionitrile Formula: C17H12ClN3O MolecularWeight: 309.74968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C#N)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@H](C#N)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H12ClN3O/c1-21-15-9-5-4-8-14(15)20-17(21)12(10-19)16(22)11-6-2-3-7-13(11)18/h2-9,12H,1H3/t12-/m1/s1