[(2S)-1-[[1-[[(2S,3S)-1-cyclohexyl-3-oxidanyl-5-pyridin-2-ylsulfanyl-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 4-azanylpiperidine-1-carboxylate

Systemtic Name: [(2S)-1-[[1-[[(2S,3S)-1-cyclohexyl-3-oxidanyl-5-pyridin-2-ylsulfanyl-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 4-azanylpiperidine-1-carboxylate Openeye Name: [(1S)-1-benzyl-2-[[2-[[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-4-(2-pyridylsulfanyl)butyl]amino]-1-methyl-2-oxo-ethyl]amino]-2-oxo-ethyl] 4-aminopiperidine-1-carboxylate CAS Name: 4-amino-1-piperidinecarboxylic acid [(2S)-1-[[1-[[(2S,3S)-1-cyclohexyl-3-hydroxy-5-(2-pyridinylthio)pentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [(2S)-1-[[1-[[(2S,3S)-1-cyclohexyl-3-hydroxy-5-pyridin-2-ylsulfanylpentan-2-yl]amino]-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-[[2-[[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-4-(2-pyridylthio)butyl]amino]-2-keto-1-methyl-ethyl]amino]-2-keto-ethyl] ester Formula: C34H49N5O5S MolecularWeight: 639.84836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1CCCCC1)C(CCSC2=CC=CC=N2)O)NC(=O)C(CC3=CC=CC=C3)OC(=O)N4CCC(CC4)N

Isomeric SMILES

CC(C(=O)N[C@@H](CC1CCCCC1)[C@H](CCSC2=CC=CC=N2)O)NC(=O)[C@H](CC3=CC=CC=C3)OC(=O)N4CCC(CC4)N

InChI

InChI=1S/C34H49N5O5S/c1-24(37-33(42)30(23-26-12-6-3-7-13-26)44-34(43)39-19-15-27(35)16-20-39)32(41)38-28(22-25-10-4-2-5-11-25)29(40)17-21-45-31-14-8-9-18-36-31/h3,6-9,12-14,18,24-25,27-30,40H,2,4-5,10-11,15-17,19-23,35H2,1H3,(H,37,42)(H,38,41)/t24?,28-,29-,30-/m0/s1