2-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]thio]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[[5-(4-fluorobenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]thio]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C21H19FN4O4S MolecularWeight: 442.463363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=O)C(=C(N2)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=O)C(=C(N2)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN4O4S/c1-12-3-8-16(26(29)30)10-18(12)24-19(27)11-31-21-23-13(2)17(20(28)25-21)9-14-4-6-15(22)7-5-14/h3-8,10H,9,11H2,1-2H3,(H,24,27)(H,23,25,28)