methyl 2-(6,6-dimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoate

Systemtic Name: methyl 2-(6,6-dimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoate Openeye Name: methyl 2-(6,6-dimethyl-2-thioxo-1H-pyrimidin-3-yl)benzoate CAS Name: 2-(6,6-dimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(6,6-dimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzoate Traditional Name: 2-(6,6-dimethyl-2-thioxo-1H-pyrimidin-3-yl)benzoic acid methyl ester Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CN(C(=S)N1)C2=CC=CC=C2C(=O)OC)C

Isomeric SMILES

CC1(C=CN(C(=S)N1)C2=CC=CC=C2C(=O)OC)C

InChI

InChI=1S/C14H16N2O2S/c1-14(2)8-9-16(13(19)15-14)11-7-5-4-6-10(11)12(17)18-3/h4-9H,1-3H3,(H,15,19)