3-(3-heptyl-9-methyl-1-oxidanyl-decoxy)-1H-pyridine-2-thione

Systemtic Name: 3-(3-heptyl-9-methyl-1-oxidanyl-decoxy)-1H-pyridine-2-thione Openeye Name: 3-(3-heptyl-1-hydroxy-9-methyl-decoxy)-1H-pyridine-2-thione CAS Name: 3-(3-heptyl-1-hydroxy-9-methyldecoxy)-1H-pyridine-2-thione IUPAC Name: 3-(3-heptyl-1-hydroxy-9-methyldecoxy)-1H-pyridine-2-thione Traditional Name: 3-(3-heptyl-1-hydroxy-9-methyl-decoxy)-1H-pyridine-2-thione Formula: C23H41NO2S MolecularWeight: 395.64214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCCC(C)C)CC(O)OC1=CC=CNC1=S

Isomeric SMILES

CCCCCCCC(CCCCCC(C)C)CC(O)OC1=CC=CNC1=S

InChI

InChI=1S/C23H41NO2S/c1-4-5-6-7-10-14-20(15-11-8-9-13-19(2)3)18-22(25)26-21-16-12-17-24-23(21)27/h12,16-17,19-20,22,25H,4-11,13-15,18H2,1-3H3,(H,24,27)