S-[(4-methoxyphenyl)methyl] 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carbothioate

Systemtic Name: S-[(4-methoxyphenyl)methyl] 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carbothioate Openeye Name: S-[(4-methoxyphenyl)methyl] 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carbothioate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carbothioic acid S-[(4-methoxyphenyl)methyl] ester IUPAC Name: S-[(4-methoxyphenyl)methyl] 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carbothioate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carbothioic acid S-p-anisyl ester Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C14H16N2O2S2/c1-9-12(7-15-14(19)16-9)13(17)20-8-10-3-5-11(18-2)6-4-10/h3-6H,7-8H2,1-2H3,(H2,15,16,19)