methyl 6-(4-hydroxyphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-(4-hydroxyphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(4-hydroxyphenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-hydroxyphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(4-hydroxyphenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-hydroxyphenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC=C(C=C2)O)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=S)C2=CC=C(C=C2)O)C(=O)OC)C

InChI

InChI=1S/C16H20N2O3S/c1-4-9-18-10(2)13(15(20)21-3)14(17-16(18)22)11-5-7-12(19)8-6-11/h5-8,14,19H,4,9H2,1-3H3,(H,17,22)