ethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(2-chloro-6-fluoro-phenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2-chloro-6-fluorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-chloro-6-fluorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2-chloro-6-fluoro-phenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H20ClFN2O2S MolecularWeight: 370.869303

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=C(C=CC=C2Cl)F)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=S)C2=C(C=CC=C2Cl)F)C(=O)OCC)C

InChI

InChI=1S/C17H20ClFN2O2S/c1-4-9-21-10(3)13(16(22)23-5-2)15(20-17(21)24)14-11(18)7-6-8-12(14)19/h6-8,15H,4-5,9H2,1-3H3,(H,20,24)