N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3,5-trimethyl-4-pyrazolesulfonamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3,5-trimethylpyrazole-4-sulfonamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3,5-trimethyl-pyrazole-4-sulfonamide Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H19N3O4S/c1-10-15(11(2)18(3)16-10)23(19,20)17-12-5-6-13-14(9-12)22-8-4-7-21-13/h5-6,9,17H,4,7-8H2,1-3H3