2-tert-butyl-7-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-tert-butyl-7-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 2-tert-butyl-7-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine CAS Name: 2-tert-butyl-7-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 2-tert-butyl-7-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Traditional Name: 2-tert-butyl-7-[4-(4-chlorophenyl)sulfonylpiperazino]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Formula: C21H23ClF3N5O2S MolecularWeight: 501.95283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C21H23ClF3N5O2S/c1-20(2,3)16-12-18-26-17(21(23,24)25)13-19(30(18)27-16)28-8-10-29(11-9-28)33(31,32)15-6-4-14(22)5-7-15/h4-7,12-13H,8-11H2,1-3H3