4-(4-methoxy-3-oxidanyl-phenyl)-3,6-dimethyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 4-(4-methoxy-3-oxidanyl-phenyl)-3,6-dimethyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 4-(3-hydroxy-4-methoxy-phenyl)-3,6-dimethyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 4-(3-hydroxy-4-methoxyphenyl)-3,6-dimethyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 4-(3-hydroxy-4-methoxyphenyl)-3,6-dimethyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 4-(3-hydroxy-4-methoxy-phenyl)-3,6-dimethyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O4S/c1-7-11(13(18)19)12(16(2)14(21)15-7)8-4-5-10(20-3)9(17)6-8/h4-6,12,17H,1-3H3,(H,15,21)(H,18,19)