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

Systemtic Name: N-(4-bromophenyl)-2-[4-(3,4-dimethylphenyl)-2-oxidanylidene-3H-1,5-benzodiazepin-1-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[4-(3,4-dimethylphenyl)-2-oxo-3H-1,5-benzodiazepin-1-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[4-(3,4-dimethylphenyl)-2-oxo-3H-1,5-benzodiazepin-1-yl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[4-(3,4-dimethylphenyl)-2-oxo-3H-1,5-benzodiazepin-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-(3,4-dimethylphenyl)-2-keto-3H-1,5-benzodiazepin-1-yl]acetamide Formula: C25H22BrN3O2 MolecularWeight: 476.36508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N(C(=O)C2)CC(=O)NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N(C(=O)C2)CC(=O)NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C25H22BrN3O2/c1-16-7-8-18(13-17(16)2)22-14-25(31)29(23-6-4-3-5-21(23)28-22)15-24(30)27-20-11-9-19(26)10-12-20/h3-13H,14-15H2,1-2H3,(H,27,30)