3-cyano-N-(3-morpholin-4-ylpropyl)-1-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide

Systemtic Name: 3-cyano-N-(3-morpholin-4-ylpropyl)-1-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide Openeye Name: 3-cyano-N-(3-morpholinopropyl)-1-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide CAS Name: 3-cyano-N-[3-(4-morpholinyl)propyl]-1-[4-(trifluoromethyl)phenyl]-2-pyrrolecarboxamide IUPAC Name: 3-cyano-N-(3-morpholin-4-ylpropyl)-1-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide Traditional Name: 3-cyano-N-(3-morpholinopropyl)-1-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide Formula: C20H21F3N4O2 MolecularWeight: 406.40155

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=C(C=CN2C3=CC=C(C=C3)C(F)(F)F)C#N

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=C(C=CN2C3=CC=C(C=C3)C(F)(F)F)C#N

InChI

InChI=1S/C20H21F3N4O2/c21-20(22,23)16-2-4-17(5-3-16)27-9-6-15(14-24)18(27)19(28)25-7-1-8-26-10-12-29-13-11-26/h2-6,9H,1,7-8,10-13H2,(H,25,28)