1-(4-tert-butylphenyl)sulfonyl-4-[3-(furan-2-yl)-1H-pyrazol-5-yl]piperidine

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-4-[3-(furan-2-yl)-1H-pyrazol-5-yl]piperidine Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-4-[3-(2-furyl)-1H-pyrazol-5-yl]piperidine CAS Name: 1-(4-tert-butylphenyl)sulfonyl-4-[3-(2-furanyl)-1H-pyrazol-5-yl]piperidine IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-4-[3-(furan-2-yl)-1H-pyrazol-5-yl]piperidine Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-4-[3-(2-furyl)-1H-pyrazol-5-yl]piperidine Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CC(=NN3)C4=CC=CO4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CC(=NN3)C4=CC=CO4

InChI

InChI=1S/C22H27N3O3S/c1-22(2,3)17-6-8-18(9-7-17)29(26,27)25-12-10-16(11-13-25)19-15-20(24-23-19)21-5-4-14-28-21/h4-9,14-16H,10-13H2,1-3H3,(H,23,24)