2-methoxyethyl 4-(5-bromanyl-2-fluoranyl-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 4-(5-bromanyl-2-fluoranyl-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 4-(5-bromo-2-fluoro-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(5-bromo-2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(5-bromo-2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(5-bromo-2-fluoro-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C15H16BrFN2O3S MolecularWeight: 403.266543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)Br)F)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)Br)F)C(=O)OCCOC

InChI

InChI=1S/C15H16BrFN2O3S/c1-8-12(14(20)22-6-5-21-2)13(19-15(23)18-8)10-7-9(16)3-4-11(10)17/h3-4,7,13H,5-6H2,1-2H3,(H2,18,19,23)