3-[(6-azanyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide

Systemtic Name: 3-[(6-azanyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide Openeye Name: 3-[(6-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide CAS Name: 3-[(6-amino-1-tert-butyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]-N,4-dimethylbenzamide IUPAC Name: 3-[(6-amino-1-tert-butylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethylbenzamide Traditional Name: 3-[(6-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide Formula: C18H23N7O MolecularWeight: 353.42152

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=NN3C(C)(C)C)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC)NC2=NC(=NC3=C2C=NN3C(C)(C)C)N

InChI

InChI=1S/C18H23N7O/c1-10-6-7-11(16(26)20-5)8-13(10)22-14-12-9-21-25(18(2,3)4)15(12)24-17(19)23-14/h6-9H,1-5H3,(H,20,26)(H3,19,22,23,24)