4-[2-(3,5-dimethylphenoxy)ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one

Systemtic Name: 4-[2-(3,5-dimethylphenoxy)ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Openeye Name: 4-[2-(3,5-dimethylphenoxy)ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one CAS Name: 4-[2-(3,5-dimethylphenoxy)ethyl]-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-piperazinone IUPAC Name: 4-[2-(3,5-dimethylphenoxy)ethyl]-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one Traditional Name: 4-[2-(3,5-dimethylphenoxy)ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H30N4O2/c1-17-14-18(2)16-22(15-17)31-13-12-28-11-10-26-25(30)24(28)23-19(3)27-29(20(23)4)21-8-6-5-7-9-21/h5-9,14-16,24H,10-13H2,1-4H3,(H,26,30)