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

Systemtic Name: 3-(4-bromophenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(4-bromophenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(4-bromophenyl)sulfonyl-5-methyl-7-(4-methyl-1-piperazinyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(4-bromophenyl)sulfonyl-5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 3-brosyl-5-methyl-7-(4-methylpiperazino)-2-(methylthio)pyrazolo[1,5-a]pyrimidine Formula: C19H22BrN5O2S2 MolecularWeight: 496.44428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22BrN5O2S2/c1-13-12-16(24-10-8-23(2)9-11-24)25-18(21-13)17(19(22-25)28-3)29(26,27)15-6-4-14(20)5-7-15/h4-7,12H,8-11H2,1-3H3