2-[4-[1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(1-benzylpyrazole-4-carbonyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(1-benzylpyrazole-4-carbonyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(1-benzylpyrazole-4-carbonyl)piperazino]-1-pyrrolidino-ethanone Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2/c27-20(24-8-4-5-9-24)17-23-10-12-25(13-11-23)21(28)19-14-22-26(16-19)15-18-6-2-1-3-7-18/h1-3,6-7,14,16H,4-5,8-13,15,17H2