4-[3-azanyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-methyl-benzenecarbothioamide

Systemtic Name: 4-[3-azanyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-methyl-benzenecarbothioamide Openeye Name: 4-[3-amino-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methyl-benzenecarbothioamide CAS Name: 4-[3-amino-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]-5-fluoro-2-methylbenzenecarbothioamide IUPAC Name: 4-[3-amino-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methylbenzenecarbothioamide Traditional Name: 4-[3-amino-2,6-diketo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methyl-thiobenzamide Formula: C13H10F4N4O2S MolecularWeight: 362.302713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=S)N)F)N2C(=O)C=C(N(C2=O)N)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1C(=S)N)F)N2C(=O)C=C(N(C2=O)N)C(F)(F)F

InChI

InChI=1S/C13H10F4N4O2S/c1-5-2-8(7(14)3-6(5)11(18)24)20-10(22)4-9(13(15,16)17)21(19)12(20)23/h2-4H,19H2,1H3,(H2,18,24)