(2R)-2-azanyl-N-[(2S,3S)-1-cyclohexyl-3-oxidanyl-4-(4-oxidanylidenepyridin-1-yl)butan-2-yl]-3-methylsulfanyl-propanamide

Systemtic Name: (2R)-2-azanyl-N-[(2S,3S)-1-cyclohexyl-3-oxidanyl-4-(4-oxidanylidenepyridin-1-yl)butan-2-yl]-3-methylsulfanyl-propanamide Openeye Name: (2R)-2-amino-N-[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-3-(4-oxo-1-pyridyl)propyl]-3-methylsulfanyl-propanamide CAS Name: (2R)-2-amino-N-[(2S,3S)-1-cyclohexyl-3-hydroxy-4-(4-oxo-1-pyridinyl)butan-2-yl]-3-(methylthio)propanamide IUPAC Name: (2R)-2-amino-N-[(2S,3S)-1-cyclohexyl-3-hydroxy-4-(4-oxopyridin-1-yl)butan-2-yl]-3-methylsulfanylpropanamide Traditional Name: (2R)-2-amino-N-[(1S,2S)-1-(cyclohexylmethyl)-2-hydroxy-3-(4-keto-1-pyridyl)propyl]-3-(methylthio)propionamide Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)NC(CC1CCCCC1)C(CN2C=CC(=O)C=C2)O)N

Isomeric SMILES

CSC[C@@H](C(=O)N[C@@H](CC1CCCCC1)[C@H](CN2C=CC(=O)C=C2)O)N

InChI

InChI=1S/C19H31N3O3S/c1-26-13-16(20)19(25)21-17(11-14-5-3-2-4-6-14)18(24)12-22-9-7-15(23)8-10-22/h7-10,14,16-18,24H,2-6,11-13,20H2,1H3,(H,21,25)/t16-,17-,18-/m0/s1