N-(3-pyrazol-1-ylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(3-pyrazol-1-ylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(3-pyrazol-1-ylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-(1-pyrazolyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(3-pyrazol-1-ylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(3-pyrazol-1-ylpropyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCN3C=CC=N3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCN3C=CC=N3)OC1

InChI

InChI=1S/C15H19N3O4S/c19-23(20,17-7-2-9-18-8-1-6-16-18)13-4-5-14-15(12-13)22-11-3-10-21-14/h1,4-6,8,12,17H,2-3,7,9-11H2