ethyl 4-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazole-5-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[7-acetamido-1-[(4-fluorophenyl)methyl]-5-benzimidazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazole-5-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[7-acetamido-1-(4-fluorobenzyl)benzimidazole-5-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H28FN5O4 MolecularWeight: 481.519323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C(=C2)NC(=O)C)N(C=N3)CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C(=C2)NC(=O)C)N(C=N3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H28FN5O4/c1-3-35-25(34)30-10-8-20(9-11-30)29-24(33)18-12-21-23(22(13-18)28-16(2)32)31(15-27-21)14-17-4-6-19(26)7-5-17/h4-7,12-13,15,20H,3,8-11,14H2,1-2H3,(H,28,32)(H,29,33)