N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonyl)piperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonyl)piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonyl)-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonyl)piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonyl)-4-piperidyl]thiophene-2-sulfonamide Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CS4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CS4)OC1

InChI

InChI=1S/C19H22N2O5S2/c22-19(14-4-5-16-17(13-14)26-11-2-10-25-16)21-8-6-15(7-9-21)20-28(23,24)18-3-1-12-27-18/h1,3-5,12-13,15,20H,2,6-11H2