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

Systemtic Name: 5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-naphthalen-2-ylsulfonyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-(2-naphthylsulfonyl)pyrazolo[1,5-a]pyrimidine CAS Name: 5-methyl-7-(4-methyl-1-piperazinyl)-2-(methylthio)-3-(2-naphthalenylsulfonyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-naphthalen-2-ylsulfonylpyrazolo[1,5-a]pyrimidine Traditional Name: 5-methyl-7-(4-methylpiperazino)-2-(methylthio)-3-(2-naphthylsulfonyl)pyrazolo[1,5-a]pyrimidine Formula: C23H25N5O2S2 MolecularWeight: 467.6069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)C)SC)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)C)SC)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H25N5O2S2/c1-16-14-20(27-12-10-26(2)11-13-27)28-22(24-16)21(23(25-28)31-3)32(29,30)19-9-8-17-6-4-5-7-18(17)15-19/h4-9,14-15H,10-13H2,1-3H3