methyl (2S)-2-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazol-5-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazole-5-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[7-acetamido-1-[(4-fluorophenyl)methyl]-5-benzimidazolyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[7-acetamido-1-[(4-fluorophenyl)methyl]benzimidazole-5-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[7-acetamido-1-(4-fluorobenzyl)benzimidazole-5-carbonyl]amino]-2-phenyl-acetic acid methyl ester Formula: C26H23FN4O4 MolecularWeight: 474.483623

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC2=C1N(C=N2)CC3=CC=C(C=C3)F)C(=O)NC(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC(=CC2=C1N(C=N2)CC3=CC=C(C=C3)F)C(=O)N[C@@H](C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C26H23FN4O4/c1-16(32)29-22-13-19(25(33)30-23(26(34)35-2)18-6-4-3-5-7-18)12-21-24(22)31(15-28-21)14-17-8-10-20(27)11-9-17/h3-13,15,23H,14H2,1-2H3,(H,29,32)(H,30,33)/t23-/m0/s1