N-cyclopropyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-cyclopropyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-4-[[[4-(4-methyl-1-piperazinyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-4-[[[4-(4-methylpiperazino)-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]benzamide Formula: C21H24F3N5OS MolecularWeight: 451.50837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=C2)C(F)(F)F)SCC3=CC=C(C=C3)C(=O)NC4CC4

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)C(F)(F)F)SCC3=CC=C(C=C3)C(=O)NC4CC4

InChI

InChI=1S/C21H24F3N5OS/c1-28-8-10-29(11-9-28)18-12-17(21(22,23)24)26-20(27-18)31-13-14-2-4-15(5-3-14)19(30)25-16-6-7-16/h2-5,12,16H,6-11,13H2,1H3,(H,25,30)