methyl 4-[(4R)-5-(2-methoxy-2-oxidanylidene-ethanoyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]benzoate

Systemtic Name: methyl 4-[(4R)-5-(2-methoxy-2-oxidanylidene-ethanoyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]benzoate Openeye Name: methyl 4-[(4R)-5-(2-methoxy-2-oxo-acetyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl]benzoate CAS Name: 4-[(4R)-5-(2-methoxy-1,2-dioxoethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4R)-5-(2-methoxy-2-oxoacetyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]benzoate Traditional Name: 4-[(4R)-5-methoxalyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid methyl ester Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)C(=O)OC)C(=O)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC=C(C=C2)C(=O)OC)C(=O)C(=O)OC

InChI

InChI=1S/C16H16N2O5S/c1-8-11(13(19)15(21)23-3)12(18-16(24)17-8)9-4-6-10(7-5-9)14(20)22-2/h4-7,12H,1-3H3,(H2,17,18,24)/t12-/m1/s1