[(2S)-1-[[(2R)-1-[[(2S,3S)-1-cyclohexyl-3-oxidanyl-4-(2-oxidanylidenepyridin-1-yl)butan-2-yl]amino]-3-methylsulfanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 4-azanylpiperidine-1-carboxylate

Systemtic Name: [(2S)-1-[[(2R)-1-[[(2S,3S)-1-cyclohexyl-3-oxidanyl-4-(2-oxidanylidenepyridin-1-yl)butan-2-yl]amino]-3-methylsulfanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 4-azanylpiperidine-1-carboxylate Openeye Name: [(1S)-1-benzyl-2-[[(1R)-2-[[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-3-(2-oxo-1-pyridyl)propyl]amino]-1-(methylsulfanylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl] 4-aminopiperidine-1-carboxylate CAS Name: 4-amino-1-piperidinecarboxylic acid [(2S)-1-[[(2R)-1-[[(2S,3S)-1-cyclohexyl-3-hydroxy-4-(2-oxo-1-pyridinyl)butan-2-yl]amino]-3-(methylthio)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [(2S)-1-[[(2R)-1-[[(2S,3S)-1-cyclohexyl-3-hydroxy-4-(2-oxopyridin-1-yl)butan-2-yl]amino]-3-methylsulfanyl-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] 4-aminopiperidine-1-carboxylate Traditional Name: 4-aminopiperidine-1-carboxylic acid [(1S)-1-benzyl-2-[[(1R)-2-[[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-3-(2-keto-1-pyridyl)propyl]amino]-2-keto-1-[(methylthio)methyl]ethyl]amino]-2-keto-ethyl] ester Formula: C34H49N5O6S MolecularWeight: 655.84776

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)NC(CC1CCCCC1)C(CN2C=CC=CC2=O)O)NC(=O)C(CC3=CC=CC=C3)OC(=O)N4CCC(CC4)N

Isomeric SMILES

CSC[C@@H](C(=O)N[C@@H](CC1CCCCC1)[C@H](CN2C=CC=CC2=O)O)NC(=O)[C@H](CC3=CC=CC=C3)OC(=O)N4CCC(CC4)N

InChI

InChI=1S/C34H49N5O6S/c1-46-23-28(32(42)36-27(20-24-10-4-2-5-11-24)29(40)22-39-17-9-8-14-31(39)41)37-33(43)30(21-25-12-6-3-7-13-25)45-34(44)38-18-15-26(35)16-19-38/h3,6-9,12-14,17,24,26-30,40H,2,4-5,10-11,15-16,18-23,35H2,1H3,(H,36,42)(H,37,43)/t27-,28-,29-,30-/m0/s1