5-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(4-bromo-2-fluoro-anilino)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-(4-bromo-2-fluoroanilino)-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(4-bromo-2-fluoroanilino)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-(4-bromo-2-fluoro-anilino)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C18H17BrFN3O2 MolecularWeight: 406.248883

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H17BrFN3O2/c1-11-8-17(24)22-15-4-2-3-5-16(15)23(11)18(25)10-21-14-7-6-12(19)9-13(14)20/h2-7,9,11,21H,8,10H2,1H3,(H,22,24)