N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-phenyl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-phenylpyrazole-4-carboxamide Traditional Name: 1-benzyl-3-phenyl-N-piperonyl-pyrazole-4-carboxamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H21N3O3/c29-25(26-14-19-11-12-22-23(13-19)31-17-30-22)21-16-28(15-18-7-3-1-4-8-18)27-24(21)20-9-5-2-6-10-20/h1-13,16H,14-15,17H2,(H,26,29)