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

Systemtic Name: 2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]-N-pentan-3-yl-ethanamide Openeye Name: 2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]-N-(1-ethylpropyl)acetamide CAS Name: 2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]-N-pentan-3-ylacetamide IUPAC Name: 2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]-N-pentan-3-ylacetamide Traditional Name: 2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]-N-(1-ethylpropyl)acetamide Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CN1CCNC(=O)C1C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCC(CC)NC(=O)CN1CCNC(=O)C1C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H31N5O2/c1-5-17(6-2)24-19(28)14-26-13-12-23-22(29)21(26)20-15(3)25-27(16(20)4)18-10-8-7-9-11-18/h7-11,17,21H,5-6,12-14H2,1-4H3,(H,23,29)(H,24,28)