tert-butyl (2S)-2-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazol-5-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[4-[(3-chloroanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C24H25ClN4O4 MolecularWeight: 468.9327

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)C2=C(N=CN2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=C(N=CN2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H25ClN4O4/c1-24(2,3)33-23(32)18(12-15-8-5-4-6-9-15)29-22(31)20-19(26-14-27-20)21(30)28-17-11-7-10-16(25)13-17/h4-11,13-14,18H,12H2,1-3H3,(H,26,27)(H,28,30)(H,29,31)/t18-/m0/s1