6-(2-bromophenyl)-8-fluoranyl-N-prop-2-enyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide

Systemtic Name: 6-(2-bromophenyl)-8-fluoranyl-N-prop-2-enyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Openeye Name: N-allyl-6-(2-bromophenyl)-8-fluoro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide CAS Name: 6-(2-bromophenyl)-8-fluoro-N-prop-2-enyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide IUPAC Name: 6-(2-bromophenyl)-8-fluoro-N-prop-2-enyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Traditional Name: N-allyl-6-(2-bromophenyl)-8-fluoro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Formula: C21H16BrFN4O MolecularWeight: 439.280343

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)F)C4=CC=CC=C4Br

Isomeric SMILES

C=CCNC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)F)C4=CC=CC=C4Br

InChI

InChI=1S/C21H16BrFN4O/c1-2-9-24-21(28)20-18-11-25-19(14-5-3-4-6-16(14)22)15-10-13(23)7-8-17(15)27(18)12-26-20/h2-8,10,12H,1,9,11H2,(H,24,28)