N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methylphenyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methylphenyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(m-tolyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methylphenyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methylphenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: 2-(m-tolyl)-5-phenyl-N-piperonyl-pyrazole-3-carboxamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H21N3O3/c1-17-6-5-9-20(12-17)28-22(14-21(27-28)19-7-3-2-4-8-19)25(29)26-15-18-10-11-23-24(13-18)31-16-30-23/h2-14H,15-16H2,1H3,(H,26,29)