2-(2-chloranyl-6-methyl-5-nitro-pyrimidin-4-yl)sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline

Systemtic Name: 2-(2-chloranyl-6-methyl-5-nitro-pyrimidin-4-yl)sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline Openeye Name: 2-(2-chloro-6-methyl-5-nitro-pyrimidin-4-yl)sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline CAS Name: 2-[(2-chloro-6-methyl-5-nitro-4-pyrimidinyl)thio]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline IUPAC Name: 2-(2-chloro-6-methyl-5-nitropyrimidin-4-yl)sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline Traditional Name: 2-[(2-chloro-6-methyl-5-nitro-pyrimidin-4-yl)thio]-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline Formula: C14H11ClF3N5O2S MolecularWeight: 405.78265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)Cl)SC2=NC3=C(CCCC3)C(=N2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)Cl)SC2=NC3=C(CCCC3)C(=N2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClF3N5O2S/c1-6-9(23(24)25)11(22-12(15)19-6)26-13-20-8-5-3-2-4-7(8)10(21-13)14(16,17)18/h2-5H2,1H3