N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(3-methylphenyl)-5-phenyl-pyrazol-3-yl]butanediamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(3-methylphenyl)-5-phenyl-pyrazol-3-yl]butanediamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(m-tolyl)-5-phenyl-pyrazol-3-yl]butanediamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(3-methylphenyl)-5-phenyl-3-pyrazolyl]butanediamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-(3-methylphenyl)-5-phenylpyrazol-3-yl]butanediamide Traditional Name: N'-[2-(m-tolyl)-5-phenyl-pyrazol-3-yl]-N-piperonyl-succinamide Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26N4O4/c1-19-6-5-9-22(14-19)32-26(16-23(31-32)21-7-3-2-4-8-21)30-28(34)13-12-27(33)29-17-20-10-11-24-25(15-20)36-18-35-24/h2-11,14-16H,12-13,17-18H2,1H3,(H,29,33)(H,30,34)