3-tert-butyl-N-cyclohexyl-N-(2-hydroxyethyl)-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-cyclohexyl-N-(2-hydroxyethyl)-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-cyclohexyl-N-(2-hydroxyethyl)pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-cyclohexyl-N-(2-hydroxyethyl)-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-cyclohexyl-N-(2-hydroxyethyl)pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-cyclohexyl-N-(2-hydroxyethyl)pyrazole-4-sulfonamide Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N(CCO)C2CCCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N(CCO)C2CCCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H33N3O3S/c1-22(2,3)21-20(17-24(23-21)16-18-10-6-4-7-11-18)29(27,28)25(14-15-26)19-12-8-5-9-13-19/h4,6-7,10-11,17,19,26H,5,8-9,12-16H2,1-3H3