1-[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]-5-(trifluoromethyl)benzotriazole

Systemtic Name: 1-[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]-5-(trifluoromethyl)benzotriazole Openeye Name: 1-[1-(4-tert-butylphenyl)sulfonyl-4-piperidyl]-5-(trifluoromethyl)benzotriazole CAS Name: 1-[1-(4-tert-butylphenyl)sulfonyl-4-piperidinyl]-5-(trifluoromethyl)benzotriazole IUPAC Name: 1-[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]-5-(trifluoromethyl)benzotriazole Traditional Name: 1-[1-(4-tert-butylphenyl)sulfonyl-4-piperidyl]-5-(trifluoromethyl)benzotriazole Formula: C22H25F3N4O2S MolecularWeight: 466.51971

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3C4=C(C=C(C=C4)C(F)(F)F)N=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3C4=C(C=C(C=C4)C(F)(F)F)N=N3

InChI

InChI=1S/C22H25F3N4O2S/c1-21(2,3)15-4-7-18(8-5-15)32(30,31)28-12-10-17(11-13-28)29-20-9-6-16(22(23,24)25)14-19(20)26-27-29/h4-9,14,17H,10-13H2,1-3H3