N-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-benzyl-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-benzyl-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-benzyl-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C21H17N3O4S2/c25-30(26,23-16-8-9-17-18(11-16)28-14-27-17)20-13-24(12-15-5-2-1-3-6-15)22-21(20)19-7-4-10-29-19/h1-11,13,23H,12,14H2