N-butyl-2-[4-[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[5-methyl-1-(m-tolyl)pyrazole-4-carbonyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[[5-methyl-1-(3-methylphenyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[5-methyl-1-(3-methylphenyl)pyrazole-4-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[5-methyl-1-(m-tolyl)pyrazole-4-carbonyl]piperazino]acetamide Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C)C

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C)C

InChI

InChI=1S/C22H31N5O2/c1-4-5-9-23-21(28)16-25-10-12-26(13-11-25)22(29)20-15-24-27(18(20)3)19-8-6-7-17(2)14-19/h6-8,14-15H,4-5,9-13,16H2,1-3H3,(H,23,28)