4-(5-bromanyl-2-fluoranyl-phenyl)-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(5-bromanyl-2-fluoranyl-phenyl)-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(5-bromo-2-fluoro-phenyl)-6-methyl-N-(5-methylisoxazol-3-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(5-bromo-2-fluorophenyl)-6-methyl-N-(5-methyl-3-isoxazolyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(5-bromo-2-fluorophenyl)-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(5-bromo-2-fluoro-phenyl)-6-methyl-N-(5-methylisoxazol-3-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C16H14BrFN4O2S MolecularWeight: 425.275363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=C(NC(=S)NC2C3=C(C=CC(=C3)Br)F)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=C(NC(=S)NC2C3=C(C=CC(=C3)Br)F)C

InChI

InChI=1S/C16H14BrFN4O2S/c1-7-5-12(22-24-7)20-15(23)13-8(2)19-16(25)21-14(13)10-6-9(17)3-4-11(10)18/h3-6,14H,1-2H3,(H2,19,21,25)(H,20,22,23)