S-pyridin-2-yl (3R)-5-(4-methoxyphenyl)-3-oxidanyl-pentanethioate

Systemtic Name: S-pyridin-2-yl (3R)-5-(4-methoxyphenyl)-3-oxidanyl-pentanethioate Openeye Name: S-(2-pyridyl) (3R)-3-hydroxy-5-(4-methoxyphenyl)pentanethioate CAS Name: (3R)-3-hydroxy-5-(4-methoxyphenyl)pentanethioic acid S-(2-pyridinyl) ester IUPAC Name: S-pyridin-2-yl (3R)-3-hydroxy-5-(4-methoxyphenyl)pentanethioate Traditional Name: (3R)-3-hydroxy-5-(4-methoxyphenyl)pentanethioic acid S-(2-pyridyl) ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(CC(=O)SC2=CC=CC=N2)O

Isomeric SMILES

COC1=CC=C(C=C1)CC[C@H](CC(=O)SC2=CC=CC=N2)O

InChI

InChI=1S/C17H19NO3S/c1-21-15-9-6-13(7-10-15)5-8-14(19)12-17(20)22-16-4-2-3-11-18-16/h2-4,6-7,9-11,14,19H,5,8,12H2,1H3/t14-/m1/s1