3-cyano-N-phenethyl-1-[3-(trifluoromethyl)phenyl]pyrrole-2-carboxamide

Systemtic Name: 3-cyano-N-phenethyl-1-[3-(trifluoromethyl)phenyl]pyrrole-2-carboxamide Openeye Name: 3-cyano-N-phenethyl-1-[3-(trifluoromethyl)phenyl]pyrrole-2-carboxamide CAS Name: 3-cyano-N-phenethyl-1-[3-(trifluoromethyl)phenyl]-2-pyrrolecarboxamide IUPAC Name: 3-cyano-N-phenethyl-1-[3-(trifluoromethyl)phenyl]pyrrole-2-carboxamide Traditional Name: 3-cyano-N-phenethyl-1-[3-(trifluoromethyl)phenyl]pyrrole-2-carboxamide Formula: C21H16F3N3O MolecularWeight: 383.36645

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=C(C=CN2C3=CC=CC(=C3)C(F)(F)F)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=C(C=CN2C3=CC=CC(=C3)C(F)(F)F)C#N

InChI

InChI=1S/C21H16F3N3O/c22-21(23,24)17-7-4-8-18(13-17)27-12-10-16(14-25)19(27)20(28)26-11-9-15-5-2-1-3-6-15/h1-8,10,12-13H,9,11H2,(H,26,28)