N-tert-butyl-4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[1-(2-chlorophenyl)-6-cyclopropyl-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[1-(2-chlorophenyl)-6-cyclopropylpyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[1-(2-chlorophenyl)-6-cyclopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine-1-carboxamide Formula: C23H28ClN7O MolecularWeight: 453.96772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4Cl)C5CC5

Isomeric SMILES

CC(C)(C)NC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4Cl)C5CC5

InChI

InChI=1S/C23H28ClN7O/c1-23(2,3)28-22(32)30-12-10-29(11-13-30)20-16-14-25-31(18-7-5-4-6-17(18)24)21(16)27-19(26-20)15-8-9-15/h4-7,14-15H,8-13H2,1-3H3,(H,28,32)