N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)isonipecotamide Formula: C24H28N4O5S MolecularWeight: 484.56792

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCCC4=NC5=CC=CC=C5N4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCCC4=NC5=CC=CC=C5N4)OC1

InChI

InChI=1S/C24H28N4O5S/c29-24(25-11-8-23-26-19-4-1-2-5-20(19)27-23)17-9-12-28(13-10-17)34(30,31)18-6-7-21-22(16-18)33-15-3-14-32-21/h1-2,4-7,16-17H,3,8-15H2,(H,25,29)(H,26,27)