3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(4-pyridylmethyl)piperazino]propan-1-one Formula: C24H29N5O MolecularWeight: 403.51996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)N3CCN(CC3)CC4=CC=NC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)N3CCN(CC3)CC4=CC=NC=C4

InChI

InChI=1S/C24H29N5O/c1-19-23(20(2)29(26-19)22-6-4-3-5-7-22)8-9-24(30)28-16-14-27(15-17-28)18-21-10-12-25-13-11-21/h3-7,10-13H,8-9,14-18H2,1-2H3