3-tert-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-homoveratryl-pyrazole-4-sulfonamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCCC2=CC(=C(C=C2)OC)OC)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCCC2=CC(=C(C=C2)OC)OC)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4S/c1-24(2,3)23-22(17-27(26-23)16-19-9-7-6-8-10-19)32(28,29)25-14-13-18-11-12-20(30-4)21(15-18)31-5/h6-12,15,17,25H,13-14,16H2,1-5H3