N-[1-(1-adamantyl)ethyl]-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]acetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]acetamide Formula: C29H39N5O2 MolecularWeight: 489.65226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)NC(C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)NC(C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H39N5O2/c1-18-26(19(2)34(32-18)24-7-5-4-6-8-24)27-28(36)30-9-10-33(27)17-25(35)31-20(3)29-14-21-11-22(15-29)13-23(12-21)16-29/h4-8,20-23,27H,9-17H2,1-3H3,(H,30,36)(H,31,35)