S-(4,6-dimethylpyrimidin-2-yl) 4-methylbenzenecarbothioate

Systemtic Name: S-(4,6-dimethylpyrimidin-2-yl) 4-methylbenzenecarbothioate Openeye Name: S-(4,6-dimethylpyrimidin-2-yl) 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-(4,6-dimethyl-2-pyrimidinyl) ester IUPAC Name: S-(4,6-dimethylpyrimidin-2-yl) 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-(4,6-dimethylpyrimidin-2-yl) ester Formula: C14H14N2OS MolecularWeight: 258.33876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)SC2=NC(=CC(=N2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)SC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C14H14N2OS/c1-9-4-6-12(7-5-9)13(17)18-14-15-10(2)8-11(3)16-14/h4-8H,1-3H3