N-(3-bromophenyl)-2-[4-(4-fluorophenyl)-2-oxidanylidene-3H-1,5-benzodiazepin-1-yl]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[4-(4-fluorophenyl)-2-oxidanylidene-3H-1,5-benzodiazepin-1-yl]ethanamide Openeye Name: N-(3-bromophenyl)-2-[4-(4-fluorophenyl)-2-oxo-3H-1,5-benzodiazepin-1-yl]acetamide CAS Name: N-(3-bromophenyl)-2-[4-(4-fluorophenyl)-2-oxo-3H-1,5-benzodiazepin-1-yl]acetamide IUPAC Name: N-(3-bromophenyl)-2-[4-(4-fluorophenyl)-2-oxo-3H-1,5-benzodiazepin-1-yl]acetamide Traditional Name: N-(3-bromophenyl)-2-[4-(4-fluorophenyl)-2-keto-3H-1,5-benzodiazepin-1-yl]acetamide Formula: C23H17BrFN3O2 MolecularWeight: 466.302383

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC(=CC=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(=NC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC(=CC=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H17BrFN3O2/c24-16-4-3-5-18(12-16)26-22(29)14-28-21-7-2-1-6-19(21)27-20(13-23(28)30)15-8-10-17(25)11-9-15/h1-12H,13-14H2,(H,26,29)