N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(2-methoxyethyl)-N-(2-thienylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(2-methoxyethyl)-N-(2-thenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C17H21NO5S2 MolecularWeight: 383.48234

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CS1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COCCN(CC1=CC=CS1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H21NO5S2/c1-21-10-7-18(13-14-4-2-11-24-14)25(19,20)15-5-6-16-17(12-15)23-9-3-8-22-16/h2,4-6,11-12H,3,7-10,13H2,1H3