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

Systemtic Name: N-(1-methylpyrazol-3-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(1-methylpyrazol-3-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(1-methyl-3-pyrazolyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(1-methylpyrazol-3-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(1-methylpyrazol-3-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN1C=CC(=N1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C13H15N3O4S/c1-16-6-5-13(14-16)15-21(17,18)10-3-4-11-12(9-10)20-8-2-7-19-11/h3-6,9H,2,7-8H2,1H3,(H,14,15)