(7Z)-7-(azepan-2-ylidene)-2,5-diphenyl-imidazo[1,2-b]pyrazol-6-one bromide

Systemtic Name: (7Z)-7-(azepan-2-ylidene)-2,5-diphenyl-imidazo[1,2-b]pyrazol-6-one bromide Openeye Name: (7Z)-7-(azepan-2-ylidene)-2,5-diphenyl-imidazo[1,2-b]pyrazol-6-one bromide CAS Name: (7Z)-7-(2-azepanylidene)-2,5-diphenyl-6-imidazo[1,2-b]pyrazolone bromide IUPAC Name: (7Z)-7-(azepan-2-ylidene)-2,5-diphenylimidazo[1,2-b]pyrazol-6-one bromide Traditional Name: (7Z)-7-(azepan-2-ylidene)-2,5-diphenyl-imidazo[1,2-b]pyrazol-6-one bromide Formula: C23H22BrN4O- MolecularWeight: 450.35098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C2C3=NC(=CN3N(C2=O)C4=CC=CC=C4)C5=CC=CC=C5)NCC1.[Br-]

Isomeric SMILES

C1CC/C(=C/2\C3=NC(=CN3N(C2=O)C4=CC=CC=C4)C5=CC=CC=C5)/NCC1.[Br-]

InChI

InChI=1S/C23H22N4O.BrH/c28-23-21(19-14-8-3-9-15-24-19)22-25-20(17-10-4-1-5-11-17)16-26(22)27(23)18-12-6-2-7-13-18;/h1-2,4-7,10-13,16,24H,3,8-9,14-15H2;1H/p-1/b21-19-;