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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-phenyl-N-piperonyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C22H17N3O3S/c26-22(23-13-15-8-9-19-20(11-15)28-14-27-19)18-12-17(21-7-4-10-29-21)24-25(18)16-5-2-1-3-6-16/h1-12H,13-14H2,(H,23,26)