4-[[1-[1-cyclopropyl-5-[(2-methoxy-2-oxidanylidene-ethyl)carbamoyl]benzimidazol-2-yl]-3-phenyl-propyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[1-[1-cyclopropyl-5-[(2-methoxy-2-oxidanylidene-ethyl)carbamoyl]benzimidazol-2-yl]-3-phenyl-propyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-[1-cyclopropyl-5-[(2-methoxy-2-oxo-ethyl)carbamoyl]benzimidazol-2-yl]-3-phenyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[1-[1-cyclopropyl-5-[[(2-methoxy-2-oxoethyl)amino]-oxomethyl]-2-benzimidazolyl]-3-phenylpropyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[1-[1-cyclopropyl-5-[(2-methoxy-2-oxoethyl)carbamoyl]benzimidazol-2-yl]-3-phenylpropyl]amino]-4-oxobutanoic acid Traditional Name: 4-[[1-[1-cyclopropyl-5-[(2-keto-2-methoxy-ethyl)carbamoyl]benzimidazol-2-yl]-3-phenyl-propyl]amino]-4-keto-butyric acid Formula: C27H30N4O6 MolecularWeight: 506.5503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC2=C(C=C1)N(C(=N2)C(CCC3=CC=CC=C3)NC(=O)CCC(=O)O)C4CC4

Isomeric SMILES

COC(=O)CNC(=O)C1=CC2=C(C=C1)N(C(=N2)C(CCC3=CC=CC=C3)NC(=O)CCC(=O)O)C4CC4

InChI

InChI=1S/C27H30N4O6/c1-37-25(35)16-28-27(36)18-8-12-22-21(15-18)30-26(31(22)19-9-10-19)20(29-23(32)13-14-24(33)34)11-7-17-5-3-2-4-6-17/h2-6,8,12,15,19-20H,7,9-11,13-14,16H2,1H3,(H,28,36)(H,29,32)(H,33,34)