N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]isonipecotamide Formula: C23H24N2O6S MolecularWeight: 456.51146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)CSC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)CSC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H24N2O6S/c26-22(13-32-17-2-4-18-21(12-17)29-10-9-28-18)25-7-5-15(6-8-25)23(27)24-16-1-3-19-20(11-16)31-14-30-19/h1-4,11-12,15H,5-10,13-14H2,(H,24,27)