N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

Systemtic Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Openeye Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide CAS Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide IUPAC Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Formula: C20H22N4O6S2 MolecularWeight: 478.54188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H22N4O6S2/c1-13-20(14(2)22-21-13)32(27,28)24-16-6-4-15(5-7-16)23-31(25,26)17-8-9-18-19(12-17)30-11-3-10-29-18/h4-9,12,23-24H,3,10-11H2,1-2H3,(H,21,22)