N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-thienyl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2-thiophenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: 2-methyl-N-[3-(piperonylcarbamoyl)-2-thienyl]pyrazole-3-carboxamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=CC=N1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N4O4S/c1-22-13(4-6-20-22)17(24)21-18-12(5-7-27-18)16(23)19-9-11-2-3-14-15(8-11)26-10-25-14/h2-8H,9-10H2,1H3,(H,19,23)(H,21,24)