N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-1,3-benzodioxole-5-carboxamide CAS Name: N-[[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-4-pyrazolyl]methyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[5-(4-ethylpiperazino)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-piperonylamide Formula: C29H37N5O3 MolecularWeight: 503.63578

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H37N5O3/c1-5-31-13-15-32(16-14-31)28-25(22(4)30-34(28)24-9-7-6-8-10-24)19-33(18-21(2)3)29(35)23-11-12-26-27(17-23)37-20-36-26/h6-12,17,21H,5,13-16,18-20H2,1-4H3