dodecyl 2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: dodecyl 2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanylethanoate Openeye Name: dodecyl 2-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]acetic acid dodecyl ester IUPAC Name: dodecyl 2-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]acetic acid lauryl ester Formula: C32H38N2O2S MolecularWeight: 514.72132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C32H38N2O2S/c1-2-3-4-5-6-7-8-9-10-17-22-36-31(35)25-37-32-29(24-33)28(26-18-13-11-14-19-26)23-30(34-32)27-20-15-12-16-21-27/h11-16,18-21,23H,2-10,17,22,25H2,1H3