N-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-phenyl-pyrazole-4-sulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-phenyl-pyrazole-4-sulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-phenyl-4-pyrazolesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-phenylpyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-1-phenyl-N-piperonyl-pyrazole-4-sulfonamide Formula: C21H23N3O4S MolecularWeight: 413.49002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4S/c1-21(2,3)20-19(13-24(23-20)16-7-5-4-6-8-16)29(25,26)22-12-15-9-10-17-18(11-15)28-14-27-17/h4-11,13,22H,12,14H2,1-3H3