3-(4-tert-butylphenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 3-(4-tert-butylphenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(4-tert-butylphenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(4-tert-butylphenyl)sulfonyl-5-methyl-7-(4-methyl-1-piperazinyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(4-tert-butylphenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 3-(4-tert-butylphenyl)sulfonyl-5-methyl-7-(4-methylpiperazino)-2-(methylthio)pyrazolo[1,5-a]pyrimidine Formula: C23H31N5O2S2 MolecularWeight: 473.65454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)C)SC)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)C)SC)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C23H31N5O2S2/c1-16-15-19(27-13-11-26(5)12-14-27)28-21(24-16)20(22(25-28)31-6)32(29,30)18-9-7-17(8-10-18)23(2,3)4/h7-10,15H,11-14H2,1-6H3