3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-(2-pyridin-4-ylethyl)piperazin-2-one

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-(2-pyridin-4-ylethyl)piperazin-2-one Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-[2-(4-pyridyl)ethyl]piperazin-2-one CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-(2-pyridin-4-ylethyl)-2-piperazinone IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-(2-pyridin-4-ylethyl)piperazin-2-one Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-[2-(4-pyridyl)ethyl]piperazin-2-one Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CCC4=CC=NC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CCC4=CC=NC=C4

InChI

InChI=1S/C22H25N5O/c1-16-20(17(2)27(25-16)19-6-4-3-5-7-19)21-22(28)24-13-15-26(21)14-10-18-8-11-23-12-9-18/h3-9,11-12,21H,10,13-15H2,1-2H3,(H,24,28)