S-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) 3,4,5-trimethoxybenzenecarbothioate

Systemtic Name: S-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) ester IUPAC Name: S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-(4-keto-6-methyl-1H-pyrimidin-2-yl) ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C15H16N2O5S/c1-8-5-12(18)17-15(16-8)23-14(19)9-6-10(20-2)13(22-4)11(7-9)21-3/h5-7H,1-4H3,(H,16,17,18)