2-(4-bromanyl-2-fluoranyl-phenoxy)-N-methyl-N-[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenoxy)-N-methyl-N-[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl]ethanamide Openeye Name: 2-(4-bromo-2-fluoro-phenoxy)-N-methyl-N-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxo-ethyl]acetamide CAS Name: 2-(4-bromo-2-fluorophenoxy)-N-methyl-N-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethyl]acetamide IUPAC Name: 2-(4-bromo-2-fluorophenoxy)-N-methyl-N-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethyl]acetamide Traditional Name: 2-(4-bromo-2-fluoro-phenoxy)-N-[2-keto-2-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethyl]-N-methyl-acetamide Formula: C21H21BrFN3O4 MolecularWeight: 478.311543

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)C(=O)COC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)C(=O)COC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C21H21BrFN3O4/c1-13-9-19(27)24-16-5-3-4-6-17(16)26(13)20(28)11-25(2)21(29)12-30-18-8-7-14(22)10-15(18)23/h3-8,10,13H,9,11-12H2,1-2H3,(H,24,27)