2-(benzotriazol-1-yl)-1-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-[1-(3-bromophenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-[1-(3-bromophenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C20H17BrN4O MolecularWeight: 409.27918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)Br)C)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)Br)C)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H17BrN4O/c1-13-10-17(14(2)25(13)16-7-5-6-15(21)11-16)20(26)12-24-19-9-4-3-8-18(19)22-23-24/h3-11H,12H2,1-2H3