tert-butyl N-[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]-3-(2-propan-2-yl-1H-imidazol-5-yl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]-3-(2-propan-2-yl-1H-imidazol-5-yl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-(benzylamino)-1-[(2-isopropyl-1H-imidazol-5-yl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-oxo-1-[(phenylmethyl)amino]-3-(2-propan-2-yl-1H-imidazol-5-yl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(benzylamino)-1-oxo-3-(2-propan-2-yl-1H-imidazol-5-yl)propan-2-yl]carbamate Traditional Name: N-[(1S)-2-(benzylamino)-1-[(2-isopropyl-1H-imidazol-5-yl)methyl]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(N1)CC(C(=O)NCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C1=NC=C(N1)C[C@@H](C(=O)NCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N4O3/c1-14(2)18-22-13-16(24-18)11-17(25-20(27)28-21(3,4)5)19(26)23-12-15-9-7-6-8-10-15/h6-10,13-14,17H,11-12H2,1-5H3,(H,22,24)(H,23,26)(H,25,27)/t17-/m0/s1