N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C17H18N4O4S MolecularWeight: 374.41422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4)C

InChI

InChI=1S/C17H18N4O4S/c1-11-14-8-12(10-18-17(14)21(2)19-11)20-26(22,23)13-4-5-15-16(9-13)25-7-3-6-24-15/h4-5,8-10,20H,3,6-7H2,1-2H3