[4,5-bis(bromanyl)-1H-pyrazol-3-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4,5-bis(bromanyl)-1H-pyrazol-3-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (4,5-dibromo-1H-pyrazol-3-yl)-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (4,5-dibromo-1H-pyrazol-3-yl)-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: (4,5-dibromo-1H-pyrazol-3-yl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (4,5-dibromo-1H-pyrazol-3-yl)-[4-(3-pyridylmethyl)piperazino]methanone Formula: C14H15Br2N5O MolecularWeight: 429.1098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C(=O)C3=NNC(=C3Br)Br

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C(=O)C3=NNC(=C3Br)Br

InChI

InChI=1S/C14H15Br2N5O/c15-11-12(18-19-13(11)16)14(22)21-6-4-20(5-7-21)9-10-2-1-3-17-8-10/h1-3,8H,4-7,9H2,(H,18,19)