(1S,3R)-1-[4-(hydroxymethyl)phenyl]-4-pyridin-2-ylsulfanyl-butane-1,3-diol

Systemtic Name: (1S,3R)-1-[4-(hydroxymethyl)phenyl]-4-pyridin-2-ylsulfanyl-butane-1,3-diol Openeye Name: (1S,3R)-1-[4-(hydroxymethyl)phenyl]-4-(2-pyridylsulfanyl)butane-1,3-diol CAS Name: (1S,3R)-1-[4-(hydroxymethyl)phenyl]-4-(2-pyridinylthio)butane-1,3-diol IUPAC Name: (1S,3R)-1-[4-(hydroxymethyl)phenyl]-4-pyridin-2-ylsulfanylbutane-1,3-diol Traditional Name: (1S,3R)-1-(4-methylolphenyl)-4-(2-pyridylthio)butane-1,3-diol Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC(CC(C2=CC=C(C=C2)CO)O)O

Isomeric SMILES

C1=CC=NC(=C1)SC[C@@H](C[C@@H](C2=CC=C(C=C2)CO)O)O

InChI

InChI=1S/C16H19NO3S/c18-10-12-4-6-13(7-5-12)15(20)9-14(19)11-21-16-3-1-2-8-17-16/h1-8,14-15,18-20H,9-11H2/t14-,15+/m1/s1