4-pyrrolidin-1-yl-2-thiophen-3-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide

Systemtic Name: 4-pyrrolidin-1-yl-2-thiophen-3-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide Openeye Name: 4-pyrrolidin-1-yl-2-(3-thienyl)-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide CAS Name: 4-(1-pyrrolidinyl)-2-(3-thiophenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]-5-pyrimidinecarboxamide IUPAC Name: 4-pyrrolidin-1-yl-2-thiophen-3-yl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxamide Traditional Name: 4-pyrrolidino-2-(3-thienyl)-N-[4-(trifluoromethyl)benzyl]pyrimidine-5-carboxamide Formula: C21H19F3N4OS MolecularWeight: 432.46197

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC=C2C(=O)NCC3=CC=C(C=C3)C(F)(F)F)C4=CSC=C4

Isomeric SMILES

C1CCN(C1)C2=NC(=NC=C2C(=O)NCC3=CC=C(C=C3)C(F)(F)F)C4=CSC=C4

InChI

InChI=1S/C21H19F3N4OS/c22-21(23,24)16-5-3-14(4-6-16)11-26-20(29)17-12-25-18(15-7-10-30-13-15)27-19(17)28-8-1-2-9-28/h3-7,10,12-13H,1-2,8-9,11H2,(H,26,29)