2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-2-(4-piperonylpiperazino)acetamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H29N5O3/c1-18-3-6-21(7-4-18)30-24(13-19(2)27-30)26-25(31)16-29-11-9-28(10-12-29)15-20-5-8-22-23(14-20)33-17-32-22/h3-8,13-14H,9-12,15-17H2,1-2H3,(H,26,31)