N-butyl-3-tert-butyl-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: N-butyl-3-tert-butyl-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-butyl-3-tert-butyl-pyrazole-4-sulfonamide CAS Name: N-butyl-3-tert-butyl-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-butyl-3-tert-butylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-butyl-3-tert-butyl-pyrazole-4-sulfonamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CN(N=C1C(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCCCNS(=O)(=O)C1=CN(N=C1C(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C18H27N3O2S/c1-5-6-12-19-24(22,23)16-14-21(20-17(16)18(2,3)4)13-15-10-8-7-9-11-15/h7-11,14,19H,5-6,12-13H2,1-4H3