N,4-dimethyl-3-[[1-phenyl-6-(2-pyrrolidin-1-ylethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide

Systemtic Name: N,4-dimethyl-3-[[1-phenyl-6-(2-pyrrolidin-1-ylethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide Openeye Name: N,4-dimethyl-3-[[1-phenyl-6-(2-pyrrolidin-1-ylethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide CAS Name: N,4-dimethyl-3-[[1-phenyl-6-[2-(1-pyrrolidinyl)ethylamino]-4-pyrazolo[3,4-d]pyrimidinyl]amino]benzamide IUPAC Name: N,4-dimethyl-3-[[1-phenyl-6-(2-pyrrolidin-1-ylethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide Traditional Name: N,4-dimethyl-3-[[1-phenyl-6-(2-pyrrolidinoethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amino]benzamide Formula: C26H30N8O MolecularWeight: 470.5694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCN5CCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCN5CCCC5

InChI

InChI=1S/C26H30N8O/c1-18-10-11-19(25(35)27-2)16-22(18)30-23-21-17-29-34(20-8-4-3-5-9-20)24(21)32-26(31-23)28-12-15-33-13-6-7-14-33/h3-5,8-11,16-17H,6-7,12-15H2,1-2H3,(H,27,35)(H2,28,30,31,32)