tert-butyl N-[(2S)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-3-(1-ethyl-2-propyl-imidazol-4-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-3-(1-ethyl-2-propyl-imidazol-4-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-[(1-ethyl-2-propyl-imidazol-4-yl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[(2S)-2-carbamoyl-1-pyrrolidinyl]-3-(1-ethyl-2-propyl-4-imidazolyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1-ethyl-2-propylimidazol-4-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[(2S)-2-carbamoylpyrrolidino]-1-[(1-ethyl-2-propyl-imidazol-4-yl)methyl]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H35N5O4 MolecularWeight: 421.5337

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=CN1CC)CC(C(=O)N2CCCC2C(=O)N)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=NC(=CN1CC)C[C@@H](C(=O)N2CCC[C@H]2C(=O)N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H35N5O4/c1-6-9-17-23-14(13-25(17)7-2)12-15(24-20(29)30-21(3,4)5)19(28)26-11-8-10-16(26)18(22)27/h13,15-16H,6-12H2,1-5H3,(H2,22,27)(H,24,29)/t15-,16-/m0/s1