ethyl 2-[4-[(4-chlorophenyl)methylcarbamoyl]phenyl]-1-(phenylmethyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[4-[(4-chlorophenyl)methylcarbamoyl]phenyl]-1-(phenylmethyl)benzimidazole-5-carboxylate Openeye Name: ethyl 1-benzyl-2-[4-[(4-chlorophenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylate CAS Name: 2-[4-[[(4-chlorophenyl)methylamino]-oxomethyl]phenyl]-1-(phenylmethyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-[4-[(4-chlorophenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-benzyl-2-[4-[(4-chlorobenzyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C31H26ClN3O3 MolecularWeight: 524.00944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C31H26ClN3O3/c1-2-38-31(37)25-14-17-28-27(18-25)34-29(35(28)20-22-6-4-3-5-7-22)23-10-12-24(13-11-23)30(36)33-19-21-8-15-26(32)16-9-21/h3-18H,2,19-20H2,1H3,(H,33,36)