tert-butyl (2S)-2-[[(2S)-3-[3-(1-adamantyloxymethyl)imidazol-4-yl]-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(2S)-3-[3-(1-adamantyloxymethyl)imidazol-4-yl]-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(1S)-1-[[3-(1-adamantyloxymethyl)imidazol-4-yl]methyl]-2-[(2S)-2-carbamoylpyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-5-oxo-pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(2S)-3-[3-(1-adamantyloxymethyl)-4-imidazolyl]-1-[(2S)-2-carbamoyl-1-pyrrolidinyl]-1-oxopropan-2-yl]amino]-oxomethyl]-5-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S)-3-[3-(1-adamantyloxymethyl)imidazol-4-yl]-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopropan-2-yl]carbamoyl]-5-oxopyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(1S)-1-[[3-(1-adamantyloxymethyl)imidazol-4-yl]methyl]-2-[(2S)-2-carbamoylpyrrolidino]-2-keto-ethyl]carbamoyl]-5-keto-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C32H46N6O7 MolecularWeight: 626.74364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCC1=O)C(=O)NC(CC2=CN=CN2COC34CC5CC(C3)CC(C5)C4)C(=O)N6CCCC6C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](CCC1=O)C(=O)N[C@@H](CC2=CN=CN2COC34CC5CC(C3)CC(C5)C4)C(=O)N6CCC[C@H]6C(=O)N

InChI

InChI=1S/C32H46N6O7/c1-31(2,3)45-30(43)38-25(6-7-26(38)39)28(41)35-23(29(42)37-8-4-5-24(37)27(33)40)12-22-16-34-17-36(22)18-44-32-13-19-9-20(14-32)11-21(10-19)15-32/h16-17,19-21,23-25H,4-15,18H2,1-3H3,(H2,33,40)(H,35,41)/t19?,20?,21?,23-,24-,25-,32?/m0/s1