1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-4-(phenylmethyl)piperidine

Systemtic Name: 1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-4-(phenylmethyl)piperidine Openeye Name: 4-benzyl-1-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-piperidine CAS Name: 1-[[3-tert-butyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]-4-(phenylmethyl)piperidine IUPAC Name: 4-benzyl-1-(1-benzyl-3-tert-butylpyrazol-4-yl)sulfonylpiperidine Traditional Name: 4-benzyl-1-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-piperidine Formula: C26H33N3O2S MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O2S/c1-26(2,3)25-24(20-28(27-25)19-23-12-8-5-9-13-23)32(30,31)29-16-14-22(15-17-29)18-21-10-6-4-7-11-21/h4-13,20,22H,14-19H2,1-3H3