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

Systemtic Name: 3-tert-butyl-N,N-dicyclohexyl-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N,N-dicyclohexyl-pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N,N-dicyclohexyl-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N,N-dicyclohexylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N,N-dicyclohexyl-pyrazole-4-sulfonamide Formula: C26H39N3O2S MolecularWeight: 457.67176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N(C2CCCCC2)C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N(C2CCCCC2)C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H39N3O2S/c1-26(2,3)25-24(20-28(27-25)19-21-13-7-4-8-14-21)32(30,31)29(22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4,7-8,13-14,20,22-23H,5-6,9-12,15-19H2,1-3H3