2-prop-2-ynoxy-4-pyrrolidin-1-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide

Systemtic Name: 2-prop-2-ynoxy-4-pyrrolidin-1-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide Openeye Name: 2-prop-2-ynoxy-4-pyrrolidin-1-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide CAS Name: 2-prop-2-ynoxy-4-(1-pyrrolidinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]-5-pyrimidinecarboxamide IUPAC Name: 2-prop-2-ynoxy-4-pyrrolidin-1-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide Traditional Name: 2-propargyloxy-4-pyrrolidino-N-[4-(trifluoromethyl)benzyl]pyrimidine-5-carboxamide Formula: C20H19F3N4O2 MolecularWeight: 404.38567

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=NC=C(C(=N1)N2CCCC2)C(=O)NCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C#CCOC1=NC=C(C(=N1)N2CCCC2)C(=O)NCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H19F3N4O2/c1-2-11-29-19-25-13-16(17(26-19)27-9-3-4-10-27)18(28)24-12-14-5-7-15(8-6-14)20(21,22)23/h1,5-8,13H,3-4,9-12H2,(H,24,28)