S-(3-cyano-6-methyl-pyridin-2-yl) 3,5-dimethoxybenzenecarbothioate

Systemtic Name: S-(3-cyano-6-methyl-pyridin-2-yl) 3,5-dimethoxybenzenecarbothioate Openeye Name: S-(3-cyano-6-methyl-2-pyridyl) 3,5-dimethoxybenzenecarbothioate CAS Name: 3,5-dimethoxybenzenecarbothioic acid S-(3-cyano-6-methyl-2-pyridinyl) ester IUPAC Name: S-(3-cyano-6-methylpyridin-2-yl) 3,5-dimethoxybenzenecarbothioate Traditional Name: 3,5-dimethoxythiobenzoic acid S-(3-cyano-6-methyl-2-pyridyl) ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C#N)SC(=O)C2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C#N)SC(=O)C2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C16H14N2O3S/c1-10-4-5-11(9-17)15(18-10)22-16(19)12-6-13(20-2)8-14(7-12)21-3/h4-8H,1-3H3