ethyl 4-(3-hydroxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3-hydroxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-hydroxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3-hydroxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-hydroxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(3-hydroxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC(=S)NC1C2=CC(=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=CNC(=S)NC1C2=CC(=CC=C2)O

InChI

InChI=1S/C13H14N2O3S/c1-2-18-12(17)10-7-14-13(19)15-11(10)8-4-3-5-9(16)6-8/h3-7,11,16H,2H2,1H3,(H2,14,15,19)