4-(3-pyridin-3-ylphenyl)-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-(3-pyridin-3-ylphenyl)-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(3-pyridyl)phenyl]-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(3-pyridinyl)phenyl]-7-(1-pyrrolidinyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-(3-pyridin-3-ylphenyl)-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(3-pyridyl)phenyl]-7-pyrrolidino-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H21F3N4O MolecularWeight: 450.45565

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=C(C=C2C(F)(F)F)NC(=O)CC(=N3)C4=CC=CC(=C4)C5=CN=CC=C5

Isomeric SMILES

C1CCN(C1)C2=CC3=C(C=C2C(F)(F)F)NC(=O)CC(=N3)C4=CC=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C25H21F3N4O/c26-25(27,28)19-12-21-22(13-23(19)32-9-1-2-10-32)30-20(14-24(33)31-21)17-6-3-5-16(11-17)18-7-4-8-29-15-18/h3-8,11-13,15H,1-2,9-10,14H2,(H,31,33)