methyl 4-[(3,4-dichlorophenyl)methylsulfanyl]-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[(3,4-dichlorophenyl)methylsulfanyl]-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-[(3,4-dichlorophenyl)methylsulfanyl]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate CAS Name: 4-[(3,4-dichlorophenyl)methylthio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[(3,4-dichlorophenyl)methylsulfanyl]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 4-[(3,4-dichlorobenzyl)thio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C14H12Cl2N2O3S MolecularWeight: 359.22768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC2=CC(=C(C=C2)Cl)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC2=CC(=C(C=C2)Cl)Cl)C(=O)OC

InChI

InChI=1S/C14H12Cl2N2O3S/c1-7-11(13(19)21-2)12(18-14(20)17-7)22-6-8-3-4-9(15)10(16)5-8/h3-5H,6H2,1-2H3,(H,17,18,20)