(2S,3S)-2-azanyl-1-cyclohexyl-5-pyridin-4-ylsulfanyl-pentan-3-ol

Systemtic Name: (2S,3S)-2-azanyl-1-cyclohexyl-5-pyridin-4-ylsulfanyl-pentan-3-ol Openeye Name: (2S,3S)-2-amino-1-cyclohexyl-5-(4-pyridylsulfanyl)pentan-3-ol CAS Name: (2S,3S)-2-amino-1-cyclohexyl-5-(pyridin-4-ylthio)-3-pentanol IUPAC Name: (2S,3S)-2-amino-1-cyclohexyl-5-pyridin-4-ylsulfanylpentan-3-ol Traditional Name: (2S,3S)-2-amino-1-cyclohexyl-5-(4-pyridylthio)pentan-3-ol Formula: C16H26N2OS MolecularWeight: 294.45544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(CCSC2=CC=NC=C2)O)N

Isomeric SMILES

C1CCC(CC1)C[C@@H]([C@H](CCSC2=CC=NC=C2)O)N

InChI

InChI=1S/C16H26N2OS/c17-15(12-13-4-2-1-3-5-13)16(19)8-11-20-14-6-9-18-10-7-14/h6-7,9-10,13,15-16,19H,1-5,8,11-12,17H2/t15-,16-/m0/s1