1-but-3-enyl-N3-(2,6-dimethylphenyl)-N6-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine

Systemtic Name: 1-but-3-enyl-N3-(2,6-dimethylphenyl)-N6-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine Openeye Name: 1-but-3-enyl-N3-(2,6-dimethylphenyl)-N6-phenyl-pyrazolo[3,4-d]pyrimidine-3,6-diamine CAS Name: 1-but-3-enyl-N3-(2,6-dimethylphenyl)-N6-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine IUPAC Name: 1-but-3-enyl-3-N-(2,6-dimethylphenyl)-6-N-phenylpyrazolo[3,4-d]pyrimidine-3,6-diamine Traditional Name: (6-anilino-1-but-3-enyl-pyrazolo[3,4-d]pyrimidin-3-yl)-(2,6-dimethylphenyl)amine Formula: C23H24N6 MolecularWeight: 384.47686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NN(C3=NC(=NC=C23)NC4=CC=CC=C4)CCC=C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NN(C3=NC(=NC=C23)NC4=CC=CC=C4)CCC=C

InChI

InChI=1S/C23H24N6/c1-4-5-14-29-22-19(15-24-23(27-22)25-18-12-7-6-8-13-18)21(28-29)26-20-16(2)10-9-11-17(20)3/h4,6-13,15H,1,5,14H2,2-3H3,(H,26,28)(H,24,25,27)