4-[[4-(3-ethoxypyrrolidin-1-yl)-6-methyl-quinolin-7-yl]methylamino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[[4-(3-ethoxypyrrolidin-1-yl)-6-methyl-quinolin-7-yl]methylamino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[[4-(3-ethoxypyrrolidin-1-yl)-6-methyl-7-quinolyl]methylamino]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[[4-(3-ethoxy-1-pyrrolidinyl)-6-methyl-7-quinolinyl]methylamino]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[[4-(3-ethoxypyrrolidin-1-yl)-6-methylquinolin-7-yl]methylamino]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[[4-(3-ethoxypyrrolidino)-6-methyl-7-quinolyl]methylamino]-2-(trifluoromethyl)benzonitrile Formula: C25H25F3N4O MolecularWeight: 454.48741

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCN(C1)C2=C3C=C(C(=CC3=NC=C2)CNC4=CC(=C(C=C4)C#N)C(F)(F)F)C

Isomeric SMILES

CCOC1CCN(C1)C2=C3C=C(C(=CC3=NC=C2)CNC4=CC(=C(C=C4)C#N)C(F)(F)F)C

InChI

InChI=1S/C25H25F3N4O/c1-3-33-20-7-9-32(15-20)24-6-8-30-23-11-18(16(2)10-21(23)24)14-31-19-5-4-17(13-29)22(12-19)25(26,27)28/h4-6,8,10-12,20,31H,3,7,9,14-15H2,1-2H3