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

Systemtic Name: (3-chloranyl-4-methyl-thiophen-2-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (3-chloro-4-methyl-2-thienyl)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-4-methyl-2-thiophenyl)methyl ester IUPAC Name: (3-chloro-4-methylthiophen-2-yl)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-4-methyl-2-thienyl)methyl ester Formula: C12H13ClN2O2S2 MolecularWeight: 316.82682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1Cl)COC(=O)C2=C(NC(=S)NC2)C

Isomeric SMILES

CC1=CSC(=C1Cl)COC(=O)C2=C(NC(=S)NC2)C

InChI

InChI=1S/C12H13ClN2O2S2/c1-6-5-19-9(10(6)13)4-17-11(16)8-3-14-12(18)15-7(8)2/h5H,3-4H2,1-2H3,(H2,14,15,18)