N-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-piperonyl-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C21H17NO3S MolecularWeight: 363.42958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17NO3S/c23-21(22-11-13-5-8-17-18(9-13)25-12-24-17)19-10-15-7-6-14-3-1-2-4-16(14)20(15)26-19/h1-5,8-10H,6-7,11-12H2,(H,22,23)