7-[2,6-bis(fluoranyl)phenyl]-9-chloranyl-3-(dimethylaminomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one

Systemtic Name: 7-[2,6-bis(fluoranyl)phenyl]-9-chloranyl-3-(dimethylaminomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Openeye Name: 9-chloro-7-(2,6-difluorophenyl)-3-(dimethylaminomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one CAS Name: 9-chloro-7-(2,6-difluorophenyl)-3-(dimethylaminomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one IUPAC Name: 9-chloro-7-(2,6-difluorophenyl)-3-(dimethylaminomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Traditional Name: 9-chloro-7-(2,6-difluorophenyl)-3-(dimethylaminomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Formula: C20H18ClF2N5O MolecularWeight: 417.839626

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CN1C(=O)CN2C(=N1)CN=C(C3=C2C=CC(=C3)Cl)C4=C(C=CC=C4F)F

Isomeric SMILES

CN(C)CN1C(=O)CN2C(=N1)CN=C(C3=C2C=CC(=C3)Cl)C4=C(C=CC=C4F)F

InChI

InChI=1S/C20H18ClF2N5O/c1-26(2)11-28-18(29)10-27-16-7-6-12(21)8-13(16)20(24-9-17(27)25-28)19-14(22)4-3-5-15(19)23/h3-8H,9-11H2,1-2H3