tert-butyl (2S)-2-[[(2S)-3-methyl-1-oxidanylidene-1-(2-pyridin-2-ylethylamino)pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(2S)-3-methyl-1-oxidanylidene-1-(2-pyridin-2-ylethylamino)pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(1S)-2-methyl-1-[2-(2-pyridyl)ethylcarbamoyl]butyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(2S)-3-methyl-1-oxo-1-[2-(2-pyridinyl)ethylamino]pentan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S)-3-methyl-1-oxo-1-(2-pyridin-2-ylethylamino)pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(1S)-2-methyl-1-[2-(2-pyridyl)ethylcarbamoyl]butyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H36N4O4 MolecularWeight: 432.55634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCC1=CC=CC=N1)NC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)[C@@H](C(=O)NCCC1=CC=CC=N1)NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C23H36N4O4/c1-6-16(2)19(21(29)25-14-12-17-10-7-8-13-24-17)26-20(28)18-11-9-15-27(18)22(30)31-23(3,4)5/h7-8,10,13,16,18-19H,6,9,11-12,14-15H2,1-5H3,(H,25,29)(H,26,28)/t16?,18-,19-/m0/s1