N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Traditional Name: 1-(1H-imidazol-5-ylsulfonyl)-N-piperonyl-nipecotamide Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H20N4O5S/c22-17(19-7-12-3-4-14-15(6-12)26-11-25-14)13-2-1-5-21(9-13)27(23,24)16-8-18-10-20-16/h3-4,6,8,10,13H,1-2,5,7,9,11H2,(H,18,20)(H,19,22)