N-(1,3-benzodioxol-5-yl)-1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[2-[2-[(methylthio)methyl]-1-benzimidazolyl]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetyl]isonipecotamide Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=CC=CC=C2N1CC(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CSCC1=NC2=CC=CC=C2N1CC(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H26N4O4S/c1-33-14-22-26-18-4-2-3-5-19(18)28(22)13-23(29)27-10-8-16(9-11-27)24(30)25-17-6-7-20-21(12-17)32-15-31-20/h2-7,12,16H,8-11,13-15H2,1H3,(H,25,30)