2-[(2R,4R,5S,6S)-5-butoxy-4-methoxy-4,6-dimethyl-oxan-2-yl]sulfanylpyridine

Systemtic Name: 2-[(2R,4R,5S,6S)-5-butoxy-4-methoxy-4,6-dimethyl-oxan-2-yl]sulfanylpyridine Openeye Name: 2-[(2R,4R,5S,6S)-5-butoxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]sulfanylpyridine CAS Name: 2-[[(2R,4R,5S,6S)-5-butoxy-4-methoxy-4,6-dimethyl-2-oxanyl]thio]pyridine IUPAC Name: 2-[(2R,4R,5S,6S)-5-butoxy-4-methoxy-4,6-dimethyloxan-2-yl]sulfanylpyridine Traditional Name: 2-[[(2R,4R,5S,6S)-5-butoxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]thio]pyridine Formula: C17H27NO3S MolecularWeight: 325.46618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C(OC(CC1(C)OC)SC2=CC=CC=N2)C

Isomeric SMILES

CCCCO[C@H]1[C@@H](O[C@@H](C[C@@]1(C)OC)SC2=CC=CC=N2)C

InChI

InChI=1S/C17H27NO3S/c1-5-6-11-20-16-13(2)21-15(12-17(16,3)19-4)22-14-9-7-8-10-18-14/h7-10,13,15-16H,5-6,11-12H2,1-4H3/t13-,15+,16-,17+/m0/s1