(4-phenyl-2-sulfanylidene-1,3-thiazol-3-yl) hexadecanoate

Systemtic Name: (4-phenyl-2-sulfanylidene-1,3-thiazol-3-yl) hexadecanoate Openeye Name: (4-phenyl-2-thioxo-thiazol-3-yl) hexadecanoate CAS Name: hexadecanoic acid (4-phenyl-2-sulfanylidene-3-thiazolyl) ester IUPAC Name: (4-phenyl-2-sulfanylidene-1,3-thiazol-3-yl) hexadecanoate Traditional Name: palmitic acid (4-phenyl-2-thioxo-4-thiazolin-3-yl) ester Formula: C25H37NO2S2 MolecularWeight: 447.69678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)ON1C(=CSC1=S)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)ON1C(=CSC1=S)C2=CC=CC=C2

InChI

InChI=1S/C25H37NO2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24(27)28-26-23(21-30-25(26)29)22-18-15-14-16-19-22/h14-16,18-19,21H,2-13,17,20H2,1H3