(2S)-2-azanyl-N-[(2S,3S)-1-cyclohexyl-3-oxidanyl-5-pyridin-2-ylsulfanyl-pentan-2-yl]hexanamide

Systemtic Name: (2S)-2-azanyl-N-[(2S,3S)-1-cyclohexyl-3-oxidanyl-5-pyridin-2-ylsulfanyl-pentan-2-yl]hexanamide Openeye Name: (2S)-2-amino-N-[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-4-(2-pyridylsulfanyl)butyl]hexanamide CAS Name: (2S)-2-amino-N-[(2S,3S)-1-cyclohexyl-3-hydroxy-5-(2-pyridinylthio)pentan-2-yl]hexanamide IUPAC Name: (2S)-2-amino-N-[(2S,3S)-1-cyclohexyl-3-hydroxy-5-pyridin-2-ylsulfanylpentan-2-yl]hexanamide Traditional Name: (2S)-2-amino-N-[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-4-(2-pyridylthio)butyl]hexanamide Formula: C22H37N3O2S MolecularWeight: 407.61308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CC1CCCCC1)C(CCSC2=CC=CC=N2)O)N

Isomeric SMILES

CCCC[C@@H](C(=O)N[C@@H](CC1CCCCC1)[C@H](CCSC2=CC=CC=N2)O)N

InChI

InChI=1S/C22H37N3O2S/c1-2-3-11-18(23)22(27)25-19(16-17-9-5-4-6-10-17)20(26)13-15-28-21-12-7-8-14-24-21/h7-8,12,14,17-20,26H,2-6,9-11,13,15-16,23H2,1H3,(H,25,27)/t18-,19-,20-/m0/s1