1-methyl-2-sulfanylidene-5-(trifluoromethyl)-1,3-diazinan-4-one

Systemtic Name: 1-methyl-2-sulfanylidene-5-(trifluoromethyl)-1,3-diazinan-4-one Openeye Name: 1-methyl-2-thioxo-5-(trifluoromethyl)hexahydropyrimidin-4-one CAS Name: 1-methyl-2-sulfanylidene-5-(trifluoromethyl)-1,3-diazinan-4-one IUPAC Name: 1-methyl-2-sulfanylidene-5-(trifluoromethyl)-1,3-diazinan-4-one Traditional Name: 1-methyl-2-thioxo-5-(trifluoromethyl)hexahydropyrimidin-4-one Formula: C6H7F3N2OS MolecularWeight: 212.19279

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C(=O)NC1=S)C(F)(F)F

Isomeric SMILES

CN1CC(C(=O)NC1=S)C(F)(F)F

InChI

InChI=1S/C6H7F3N2OS/c1-11-2-3(6(7,8)9)4(12)10-5(11)13/h3H,2H2,1H3,(H,10,12,13)