ethyl 2-[[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]carbonyl-phenyl-amino]ethanoate

Systemtic Name: ethyl 2-[[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]carbonyl-phenyl-amino]ethanoate Openeye Name: ethyl 2-(N-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazole-5-carbonyl]anilino)acetate CAS Name: 2-(N-[[2-[(4-cyanophenyl)methyl]-1-methyl-5-benzimidazolyl]-oxomethyl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[2-[(4-cyanophenyl)methyl]-1-methylbenzimidazole-5-carbonyl]anilino)acetate Traditional Name: 2-(N-[2-(4-cyanobenzyl)-1-methyl-benzimidazole-5-carbonyl]anilino)acetic acid ethyl ester Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C#N)C

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)N(C(=N3)CC4=CC=C(C=C4)C#N)C

InChI

InChI=1S/C27H24N4O3/c1-3-34-26(32)18-31(22-7-5-4-6-8-22)27(33)21-13-14-24-23(16-21)29-25(30(24)2)15-19-9-11-20(17-28)12-10-19/h4-14,16H,3,15,18H2,1-2H3