S-(4-phenylpyrimidin-2-yl) 3,5-dimethoxybenzenecarbothioate

Systemtic Name: S-(4-phenylpyrimidin-2-yl) 3,5-dimethoxybenzenecarbothioate Openeye Name: S-(4-phenylpyrimidin-2-yl) 3,5-dimethoxybenzenecarbothioate CAS Name: 3,5-dimethoxybenzenecarbothioic acid S-(4-phenyl-2-pyrimidinyl) ester IUPAC Name: S-(4-phenylpyrimidin-2-yl) 3,5-dimethoxybenzenecarbothioate Traditional Name: 3,5-dimethoxythiobenzoic acid S-(4-phenylpyrimidin-2-yl) ester Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)SC2=NC=CC(=N2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)SC2=NC=CC(=N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H16N2O3S/c1-23-15-10-14(11-16(12-15)24-2)18(22)25-19-20-9-8-17(21-19)13-6-4-3-5-7-13/h3-12H,1-2H3