4-[[4-(dimethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-benzamide

Systemtic Name: 4-[[4-(dimethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-benzamide Openeye Name: 4-[[4-(dimethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-isopropyl-benzamide CAS Name: 4-[[[4-(dimethylamino)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-N-propan-2-ylbenzamide IUPAC Name: 4-[[4-(dimethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-ylbenzamide Traditional Name: 4-[[[4-(dimethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]-N-isopropyl-benzamide Formula: C18H21F3N4OS MolecularWeight: 398.44575

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(C)C)C(F)(F)F

Isomeric SMILES

CC(C)NC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(C)C)C(F)(F)F

InChI

InChI=1S/C18H21F3N4OS/c1-11(2)22-16(26)13-7-5-12(6-8-13)10-27-17-23-14(18(19,20)21)9-15(24-17)25(3)4/h5-9,11H,10H2,1-4H3,(H,22,26)