7-ethoxy-4-[3-(2-pyrrolidin-1-ylpyridin-4-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 7-ethoxy-4-[3-(2-pyrrolidin-1-ylpyridin-4-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 7-ethoxy-4-[3-(2-pyrrolidin-1-yl-4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 7-ethoxy-4-[3-[2-(1-pyrrolidinyl)-4-pyridinyl]phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 7-ethoxy-4-[3-(2-pyrrolidin-1-ylpyridin-4-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 7-ethoxy-4-[3-(2-pyrrolidino-4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C27H25F3N4O2 MolecularWeight: 494.50821

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CC(=NC=C4)N5CCCC5

Isomeric SMILES

CCOC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CC(=NC=C4)N5CCCC5

InChI

InChI=1S/C27H25F3N4O2/c1-2-36-24-15-23-22(14-20(24)27(28,29)30)33-26(35)16-21(32-23)19-7-5-6-17(12-19)18-8-9-31-25(13-18)34-10-3-4-11-34/h5-9,12-15H,2-4,10-11,16H2,1H3,(H,33,35)