5-methyl-6-(2-methylpropyl)-2-(trichloromethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-methyl-6-(2-methylpropyl)-2-(trichloromethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-isobutyl-5-methyl-2-(trichloromethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-6-(2-methylpropyl)-2-(trichloromethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-methyl-6-(2-methylpropyl)-2-(trichloromethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-isobutyl-5-methyl-2-(trichloromethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C12H13Cl3N2OS MolecularWeight: 339.66842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(Cl)(Cl)Cl)CC(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C(Cl)(Cl)Cl)CC(C)C

InChI

InChI=1S/C12H13Cl3N2OS/c1-5(2)4-7-6(3)8-9(18)16-11(12(13,14)15)17-10(8)19-7/h5H,4H2,1-3H3,(H,16,17,18)