3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: 3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one Openeye Name: 3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-(2-methylindolin-1-yl)propan-1-one CAS Name: 3-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-1-(2-methyl-2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 3-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-1-(2-methylindolin-1-yl)propan-1-one Formula: C24H20F3N3O3S MolecularWeight: 487.49411

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CCSC3=NC(=CC(=N3)C(F)(F)F)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CCSC3=NC(=CC(=N3)C(F)(F)F)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H20F3N3O3S/c1-14-10-16-4-2-3-5-18(16)30(14)22(31)8-9-34-23-28-17(12-21(29-23)24(25,26)27)15-6-7-19-20(11-15)33-13-32-19/h2-7,11-12,14H,8-10,13H2,1H3