2-[4-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]-oxomethyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazino]-1-piperidino-ethanone Formula: C21H26BrN5O2 MolecularWeight: 460.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H26BrN5O2/c22-17-6-4-16(5-7-17)18-14-19(24-23-18)21(29)27-12-10-25(11-13-27)15-20(28)26-8-2-1-3-9-26/h4-7,14H,1-3,8-13,15H2,(H,23,24)