butyl (2S)-2-[[4-[[(2S)-1-butoxy-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: butyl (2S)-2-[[4-[[(2S)-1-butoxy-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-1H-imidazol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: butyl (2S)-2-[[4-[[(1S)-1-benzyl-2-butoxy-2-oxo-ethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[4-[[[(2S)-1-butoxy-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-3-phenylpropanoic acid butyl ester IUPAC Name: butyl (2S)-2-[[4-[[(2S)-1-butoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl]-1H-imidazole-5-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[4-[[(1S)-1-benzyl-2-butoxy-2-keto-ethyl]carbamoyl]-1H-imidazole-5-carbonyl]amino]-3-phenyl-propionic acid butyl ester Formula: C31H38N4O6 MolecularWeight: 562.65662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=C(N=CN2)C(=O)NC(CC3=CC=CC=C3)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=C(N=CN2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OCCCC

InChI

InChI=1S/C31H38N4O6/c1-3-5-17-40-30(38)24(19-22-13-9-7-10-14-22)34-28(36)26-27(33-21-32-26)29(37)35-25(31(39)41-18-6-4-2)20-23-15-11-8-12-16-23/h7-16,21,24-25H,3-6,17-20H2,1-2H3,(H,32,33)(H,34,36)(H,35,37)/t24-,25-/m0/s1