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

Systemtic Name: 3-[(6-azanyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[(6-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[(6-amino-1-tert-butyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[(6-amino-1-tert-butylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[(6-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-cyclopropyl-4-methyl-benzamide Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC3=NC(=NC4=C3C=NN4C(C)(C)C)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC3=NC(=NC4=C3C=NN4C(C)(C)C)N

InChI

InChI=1S/C20H25N7O/c1-11-5-6-12(18(28)23-13-7-8-13)9-15(11)24-16-14-10-22-27(20(2,3)4)17(14)26-19(21)25-16/h5-6,9-10,13H,7-8H2,1-4H3,(H,23,28)(H3,21,24,25,26)