2-[(5R,6R)-5-methyl-6,7-bis(phenylmethoxy)hept-1-en-3-yl]sulfanylpyridine

Systemtic Name: 2-[(5R,6R)-5-methyl-6,7-bis(phenylmethoxy)hept-1-en-3-yl]sulfanylpyridine Openeye Name: 2-[(3R,4R)-4,5-dibenzyloxy-3-methyl-1-vinyl-pentyl]sulfanylpyridine CAS Name: 2-[[(5R,6R)-5-methyl-6,7-bis(phenylmethoxy)hept-1-en-3-yl]thio]pyridine IUPAC Name: 2-[(5R,6R)-5-methyl-6,7-bis(phenylmethoxy)hept-1-en-3-yl]sulfanylpyridine Traditional Name: 2-[1-[(2R,3R)-3,4-dibenzoxy-2-methyl-butyl]allylthio]pyridine Formula: C27H31NO2S MolecularWeight: 433.60554

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C=C)SC1=CC=CC=N1)C(COCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C[C@H](CC(C=C)SC1=CC=CC=N1)[C@H](COCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H31NO2S/c1-3-25(31-27-16-10-11-17-28-27)18-22(2)26(30-20-24-14-8-5-9-15-24)21-29-19-23-12-6-4-7-13-23/h3-17,22,25-26H,1,18-21H2,2H3/t22-,25?,26+/m1/s1