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

Systemtic Name: (3-chloranyl-5-methoxy-phenyl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (3-chloro-5-methoxy-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 (3-chloro-5-methoxyphenyl)methyl ester IUPAC Name: (3-chloro-5-methoxyphenyl)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 (3-chloro-5-methoxy-benzyl) ester Formula: C14H15ClN2O3S MolecularWeight: 326.7985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=CC(=CC(=C2)Cl)OC

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=CC(=CC(=C2)Cl)OC

InChI

InChI=1S/C14H15ClN2O3S/c1-8-12(6-16-14(21)17-8)13(18)20-7-9-3-10(15)5-11(4-9)19-2/h3-5H,6-7H2,1-2H3,(H2,16,17,21)