3-(2-methoxyphenyl)-5,5-dimethyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4H-pyrimidin-6-one

Systemtic Name: 3-(2-methoxyphenyl)-5,5-dimethyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4H-pyrimidin-6-one Openeye Name: 3-(2-methoxyphenyl)-5,5-dimethyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4H-pyrimidin-6-one CAS Name: 3-(2-methoxyphenyl)-5,5-dimethyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-4H-pyrimidin-6-one IUPAC Name: 3-(2-methoxyphenyl)-5,5-dimethyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4H-pyrimidin-6-one Traditional Name: 3-(2-methoxyphenyl)-5,5-dimethyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-4H-pyrimidin-6-one Formula: C20H18F3N3O4S MolecularWeight: 453.43483

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=NC1=O)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=CC=C3OC)C

Isomeric SMILES

CC1(CN(C(=NC1=O)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=CC=C3OC)C

InChI

InChI=1S/C20H18F3N3O4S/c1-19(2)11-25(13-6-4-5-7-15(13)30-3)18(24-17(19)27)31-16-9-8-12(20(21,22)23)10-14(16)26(28)29/h4-10H,11H2,1-3H3