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

Systemtic Name: 4-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Openeye Name: 4-[2-(azocan-1-yl)-2-oxo-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one CAS Name: 4-[2-(1-azocanyl)-2-oxoethyl]-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-piperazinone IUPAC Name: 4-[2-(azocan-1-yl)-2-oxoethyl]-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one Traditional Name: 4-[2-(azocan-1-yl)-2-keto-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Formula: C24H33N5O2 MolecularWeight: 423.55112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)N4CCCCCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)N4CCCCCCC4

InChI

InChI=1S/C24H33N5O2/c1-18-22(19(2)29(26-18)20-11-7-6-8-12-20)23-24(31)25-13-16-28(23)17-21(30)27-14-9-4-3-5-10-15-27/h6-8,11-12,23H,3-5,9-10,13-17H2,1-2H3,(H,25,31)