N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C18H18N2O5S2 MolecularWeight: 406.47592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H18N2O5S2/c1-2-23-12-4-6-14-17(10-12)26-18(19-14)20-27(21,22)13-5-7-15-16(11-13)25-9-3-8-24-15/h4-7,10-11H,2-3,8-9H2,1H3,(H,19,20)