tert-butyl N-[(2S)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-1-oxidanylidene-3-(3-prop-2-enylimidazol-4-yl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-1-oxidanylidene-3-(3-prop-2-enylimidazol-4-yl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(3-allylimidazol-4-yl)methyl]-2-[(2S)-2-carbamoylpyrrolidin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[(2S)-2-carbamoyl-1-pyrrolidinyl]-1-oxo-3-(3-prop-2-enyl-4-imidazolyl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxo-3-(3-prop-2-enylimidazol-4-yl)propan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3-allylimidazol-4-yl)methyl]-2-[(2S)-2-carbamoylpyrrolidino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C19H29N5O4 MolecularWeight: 391.46466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CN=CN1CC=C)C(=O)N2CCCC2C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CN=CN1CC=C)C(=O)N2CCC[C@H]2C(=O)N

InChI

InChI=1S/C19H29N5O4/c1-5-8-23-12-21-11-13(23)10-14(22-18(27)28-19(2,3)4)17(26)24-9-6-7-15(24)16(20)25/h5,11-12,14-15H,1,6-10H2,2-4H3,(H2,20,25)(H,22,27)/t14-,15-/m0/s1