2-[[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[1-(3,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethyl-diethylazanium Traditional Name: 2-[[1-(3,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]ethyl-diethyl-ammonium Formula: C19H27N6+ MolecularWeight: 339.45788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC=NC2=C1C=NN2C3=CC(=C(C=C3)C)C

Isomeric SMILES

CC[NH+](CC)CCNC1=NC=NC2=C1C=NN2C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C19H26N6/c1-5-24(6-2)10-9-20-18-17-12-23-25(19(17)22-13-21-18)16-8-7-14(3)15(4)11-16/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,20,21,22)/p+1