N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylphenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: 6-keto-N-piperonyl-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CS5

InChI

InChI=1S/C25H24N2O4S/c1-16-4-7-18(8-5-16)27-23(28)11-9-19(24(27)22-3-2-12-32-22)25(29)26-14-17-6-10-20-21(13-17)31-15-30-20/h2-8,10,12-13,19,24H,9,11,14-15H2,1H3,(H,26,29)