4-(4-ethylpiperazin-4-ium-1-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C17H21N6+ MolecularWeight: 309.38884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H20N6/c1-2-21-8-10-22(11-9-21)16-15-12-20-23(17(15)19-13-18-16)14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3/p+1