(2-sulfanylidene-1H-pyridin-3-yl) hexadecanoate

Systemtic Name: (2-sulfanylidene-1H-pyridin-3-yl) hexadecanoate Openeye Name: (2-thioxo-1H-pyridin-3-yl) hexadecanoate CAS Name: hexadecanoic acid (2-sulfanylidene-1H-pyridin-3-yl) ester IUPAC Name: (2-sulfanylidene-1H-pyridin-3-yl) hexadecanoate Traditional Name: palmitic acid (2-thioxo-1H-pyridin-3-yl) ester Formula: C21H35NO2S MolecularWeight: 365.5731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1=CC=CNC1=S

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1=CC=CNC1=S

InChI

InChI=1S/C21H35NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(23)24-19-16-15-18-22-21(19)25/h15-16,18H,2-14,17H2,1H3,(H,22,25)