N-[[1-(cyclohexen-1-ylmethyl)pyrrolidin-2-yl]methyl]-8-(methylsulfamoyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide

Systemtic Name: N-[[1-(cyclohexen-1-ylmethyl)pyrrolidin-2-yl]methyl]-8-(methylsulfamoyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Openeye Name: N-[[1-(cyclohexen-1-ylmethyl)pyrrolidin-2-yl]methyl]-8-(methylsulfamoyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide CAS Name: N-[[1-(1-cyclohexenylmethyl)-2-pyrrolidinyl]methyl]-8-(methylsulfamoyl)-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide IUPAC Name: N-[[1-(cyclohexen-1-ylmethyl)pyrrolidin-2-yl]methyl]-8-(methylsulfamoyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Traditional Name: N-[[1-(cyclohexen-1-ylmethyl)pyrrolidin-2-yl]methyl]-8-(methylsulfamoyl)-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide Formula: C23H33N3O5S MolecularWeight: 463.59022

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC2=C(C(=C1)C(=O)NCC3CCCN3CC4=CCCCC4)OCCCO2

Isomeric SMILES

CNS(=O)(=O)C1=CC2=C(C(=C1)C(=O)NCC3CCCN3CC4=CCCCC4)OCCCO2

InChI

InChI=1S/C23H33N3O5S/c1-24-32(28,29)19-13-20(22-21(14-19)30-11-6-12-31-22)23(27)25-15-18-9-5-10-26(18)16-17-7-3-2-4-8-17/h7,13-14,18,24H,2-6,8-12,15-16H2,1H3,(H,25,27)