5-[3,5-bis(fluoranyl)phenyl]-2-methyl-8-pyridazin-3-yl-1,3,4,5-tetrahydro-2-benzazepine

Systemtic Name: 5-[3,5-bis(fluoranyl)phenyl]-2-methyl-8-pyridazin-3-yl-1,3,4,5-tetrahydro-2-benzazepine Openeye Name: 5-(3,5-difluorophenyl)-2-methyl-8-pyridazin-3-yl-1,3,4,5-tetrahydro-2-benzazepine CAS Name: 5-(3,5-difluorophenyl)-2-methyl-8-(3-pyridazinyl)-1,3,4,5-tetrahydro-2-benzazepine IUPAC Name: 5-(3,5-difluorophenyl)-2-methyl-8-pyridazin-3-yl-1,3,4,5-tetrahydro-2-benzazepine Traditional Name: 5-(3,5-difluorophenyl)-2-methyl-8-pyridazin-3-yl-1,3,4,5-tetrahydro-2-benzazepine Formula: C21H19F2N3 MolecularWeight: 351.392466

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C2=C(C1)C=C(C=C2)C3=NN=CC=C3)C4=CC(=CC(=C4)F)F

Isomeric SMILES

CN1CCC(C2=C(C1)C=C(C=C2)C3=NN=CC=C3)C4=CC(=CC(=C4)F)F

InChI

InChI=1S/C21H19F2N3/c1-26-8-6-20(15-10-17(22)12-18(23)11-15)19-5-4-14(9-16(19)13-26)21-3-2-7-24-25-21/h2-5,7,9-12,20H,6,8,13H2,1H3