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

Systemtic Name: N-ethyl-N-methyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-ethyl-N-methyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-ethyl-N-methyl-4-[[[4-(4-methyl-1-piperazinyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-ethyl-N-methyl-4-[[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-ethyl-N-methyl-4-[[[4-(4-methylpiperazino)-6-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]benzamide Formula: C21H26F3N5OS MolecularWeight: 453.52425

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCN(CC3)C)C(F)(F)F

Isomeric SMILES

CCN(C)C(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCN(CC3)C)C(F)(F)F

InChI

InChI=1S/C21H26F3N5OS/c1-4-28(3)19(30)16-7-5-15(6-8-16)14-31-20-25-17(21(22,23)24)13-18(26-20)29-11-9-27(2)10-12-29/h5-8,13H,4,9-12,14H2,1-3H3