N-[2-(pyrrolidin-3-ylamino)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]propanamide

Systemtic Name: N-[2-(pyrrolidin-3-ylamino)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]propanamide Openeye Name: N-[2-(pyrrolidin-3-ylamino)-6-quinolyl]-3-[4-(trifluoromethyl)phenyl]propanamide CAS Name: N-[2-(3-pyrrolidinylamino)-6-quinolinyl]-3-[4-(trifluoromethyl)phenyl]propanamide IUPAC Name: N-[2-(pyrrolidin-3-ylamino)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]propanamide Traditional Name: N-[2-(pyrrolidin-3-ylamino)-6-quinolyl]-3-[4-(trifluoromethyl)phenyl]propionamide Formula: C23H23F3N4O MolecularWeight: 428.45013

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1NC2=NC3=C(C=C2)C=C(C=C3)NC(=O)CCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CNCC1NC2=NC3=C(C=C2)C=C(C=C3)NC(=O)CCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H23F3N4O/c24-23(25,26)17-5-1-15(2-6-17)3-10-22(31)29-18-7-8-20-16(13-18)4-9-21(30-20)28-19-11-12-27-14-19/h1-2,4-9,13,19,27H,3,10-12,14H2,(H,28,30)(H,29,31)