ethyl 3-[(3-cyano-4-phenyl-phenyl)methyl]-2-(ethylamino)benzimidazole-4-carboxylate

Systemtic Name: ethyl 3-[(3-cyano-4-phenyl-phenyl)methyl]-2-(ethylamino)benzimidazole-4-carboxylate Openeye Name: ethyl 3-[(3-cyano-4-phenyl-phenyl)methyl]-2-(ethylamino)benzimidazole-4-carboxylate CAS Name: 3-[(3-cyano-4-phenylphenyl)methyl]-2-(ethylamino)-4-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-cyano-4-phenylphenyl)methyl]-2-(ethylamino)benzimidazole-4-carboxylate Traditional Name: 3-(3-cyano-4-phenyl-benzyl)-2-(ethylamino)benzimidazole-4-carboxylic acid ethyl ester Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=CC=CC(=C2N1CC3=CC(=C(C=C3)C4=CC=CC=C4)C#N)C(=O)OCC

Isomeric SMILES

CCNC1=NC2=CC=CC(=C2N1CC3=CC(=C(C=C3)C4=CC=CC=C4)C#N)C(=O)OCC

InChI

InChI=1S/C26H24N4O2/c1-3-28-26-29-23-12-8-11-22(25(31)32-4-2)24(23)30(26)17-18-13-14-21(20(15-18)16-27)19-9-6-5-7-10-19/h5-15H,3-4,17H2,1-2H3,(H,28,29)