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

Systemtic Name: S-[(4R)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[(4R)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[(4R)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl] ester IUPAC Name: S-[(4R)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[(4R)-6-keto-4-methyl-4,5-dihydro-1H-pyrimidin-2-yl] ester Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC(=N1)SC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

C[C@@H]1CC(=O)NC(=N1)SC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C15H18N2O5S/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/h6-8H,5H2,1-4H3,(H,16,17,18)/t8-/m1/s1