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

Systemtic Name: 4-[3-(2-methylpyridin-4-yl)phenyl]-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(2-methyl-4-pyridyl)phenyl]-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(2-methyl-4-pyridinyl)phenyl]-7-(1-pyrrolidinyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(2-methylpyridin-4-yl)phenyl]-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(2-methyl-4-pyridyl)phenyl]-7-pyrrolidino-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C26H23F3N4O MolecularWeight: 464.48223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C(=C4)N5CCCC5)C(F)(F)F)NC(=O)C3

Isomeric SMILES

CC1=NC=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C(=C4)N5CCCC5)C(F)(F)F)NC(=O)C3

InChI

InChI=1S/C26H23F3N4O/c1-16-11-18(7-8-30-16)17-5-4-6-19(12-17)21-15-25(34)32-22-13-20(26(27,28)29)24(14-23(22)31-21)33-9-2-3-10-33/h4-8,11-14H,2-3,9-10,15H2,1H3,(H,32,34)