4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]-N-[2-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(2-methyl-6-pyrrolidino-pyrimidin-4-yl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C21H25F3N6O MolecularWeight: 434.45801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)NC3=CC=CC=C3C(F)(F)F)N4CCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)NC3=CC=CC=C3C(F)(F)F)N4CCCC4

InChI

InChI=1S/C21H25F3N6O/c1-15-25-18(28-8-4-5-9-28)14-19(26-15)29-10-12-30(13-11-29)20(31)27-17-7-3-2-6-16(17)21(22,23)24/h2-3,6-7,14H,4-5,8-13H2,1H3,(H,27,31)