(4-propoxyphenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (4-propoxyphenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4-propoxyphenyl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-propoxyphenyl)methyl ester IUPAC Name: (4-propoxyphenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-propoxybenzyl) ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)COC(=O)C2=C(NC(=S)NC2)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)COC(=O)C2=C(NC(=S)NC2)C

InChI

InChI=1S/C16H20N2O3S/c1-3-8-20-13-6-4-12(5-7-13)10-21-15(19)14-9-17-16(22)18-11(14)2/h4-7H,3,8-10H2,1-2H3,(H2,17,18,22)