(2S)-2-azanyl-N-[(2S,3S)-1-cyclohexyl-3-oxidanyl-5-pyridin-2-ylsulfanyl-pentan-2-yl]-4-methyl-pentanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H37N3O2S/c1-16(2)14-18(23)22(27)25-19(15-17-8-4-3-5-9-17)20(26)11-13-28-21-10-6-7-12-24-21/h6-7,10,12,16-20,26H,3-5,8-9,11,13-15,23H2,1-2H3,(H,25,27)/t18-,19-,20-/m0/s1