3,5-dimethyl-4-[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]-1H-pyrrole-2-carbonitrile

Systemtic Name: 3,5-dimethyl-4-[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]-1H-pyrrole-2-carbonitrile Openeye Name: 4-(6-benzoyl-1H-benzimidazol-2-yl)-3,5-dimethyl-1H-pyrrole-2-carbonitrile CAS Name: 4-(6-benzoyl-1H-benzimidazol-2-yl)-3,5-dimethyl-1H-pyrrole-2-carbonitrile IUPAC Name: 4-(6-benzoyl-1H-benzimidazol-2-yl)-3,5-dimethyl-1H-pyrrole-2-carbonitrile Traditional Name: 4-(6-benzoyl-1H-benzimidazol-2-yl)-3,5-dimethyl-1H-pyrrole-2-carbonitrile Formula: C21H16N4O MolecularWeight: 340.37794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C)C#N

Isomeric SMILES

CC1=C(NC(=C1C2=NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C)C#N

InChI

InChI=1S/C21H16N4O/c1-12-18(11-22)23-13(2)19(12)21-24-16-9-8-15(10-17(16)25-21)20(26)14-6-4-3-5-7-14/h3-10,23H,1-2H3,(H,24,25)