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

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-thienyl]-1-ethyl-pyrazole-3-carboxamide CAS Name: N-[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2-thiophenyl]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-1-ethylpyrazole-3-carboxamide Traditional Name: 1-ethyl-N-[3-(piperonylcarbamoyl)-2-thienyl]pyrazole-3-carboxamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN1C=CC(=N1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H18N4O4S/c1-2-23-7-5-14(22-23)18(25)21-19-13(6-8-28-19)17(24)20-10-12-3-4-15-16(9-12)27-11-26-15/h3-9H,2,10-11H2,1H3,(H,20,24)(H,21,25)