N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C22H19N3O4S2 MolecularWeight: 453.53396

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C22H19N3O4S2/c26-31(27,24-17-8-9-18-19(13-17)29-11-10-28-18)21-15-25(14-16-5-2-1-3-6-16)23-22(21)20-7-4-12-30-20/h1-9,12-13,15,24H,10-11,14H2