6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-1-phenethyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-1-phenethyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-1-phenethyl-pyrazolo[3,4-d]pyrimidine CAS Name: 6-methyl-4-(4-methyl-1-piperazin-4-iumyl)-1-phenethylpyrazolo[3,4-d]pyrimidine IUPAC Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-1-phenethylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-1-phenethyl-pyrazolo[3,4-d]pyrimidine Formula: C19H25N6+ MolecularWeight: 337.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CCC3=CC=CC=C3)C(=N1)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=NC2=C(C=NN2CCC3=CC=CC=C3)C(=N1)N4CC[NH+](CC4)C

InChI

InChI=1S/C19H24N6/c1-15-21-18(24-12-10-23(2)11-13-24)17-14-20-25(19(17)22-15)9-8-16-6-4-3-5-7-16/h3-7,14H,8-13H2,1-2H3/p+1