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

Systemtic Name: 1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-4-(phenylmethyl)piperidine Openeye Name: 4-benzyl-1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-piperidine CAS Name: 1-[(3-tert-butyl-1-cyclopentyl-4-pyrazolyl)sulfonyl]-4-(phenylmethyl)piperidine IUPAC Name: 4-benzyl-1-(3-tert-butyl-1-cyclopentylpyrazol-4-yl)sulfonylpiperidine Traditional Name: 4-benzyl-1-(3-tert-butyl-1-cyclopentyl-pyrazol-4-yl)sulfonyl-piperidine Formula: C24H35N3O2S MolecularWeight: 429.6186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)C4CCCC4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)C4CCCC4

InChI

InChI=1S/C24H35N3O2S/c1-24(2,3)23-22(18-27(25-23)21-11-7-8-12-21)30(28,29)26-15-13-20(14-16-26)17-19-9-5-4-6-10-19/h4-6,9-10,18,20-21H,7-8,11-17H2,1-3H3