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

Systemtic Name: (4-methoxy-3,5-dimethyl-phenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4-methoxy-3,5-dimethyl-phenyl)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-methoxy-3,5-dimethylphenyl)methyl ester IUPAC Name: (4-methoxy-3,5-dimethylphenyl)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-methoxy-3,5-dimethyl-benzyl) ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)COC(=O)C2=C(NC(=S)NC2)C

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)COC(=O)C2=C(NC(=S)NC2)C

InChI

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