4-(6-cyclopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide

Systemtic Name: 4-(6-cyclopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide Openeye Name: 4-(6-cyclopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide CAS Name: 4-(6-cyclopropyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-N-propyl-1-piperazinecarboxamide IUPAC Name: 4-(6-cyclopropyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)-N-propylpiperazine-1-carboxamide Traditional Name: 4-(6-cyclopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide Formula: C22H27N7O MolecularWeight: 405.49608

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4)C5CC5

Isomeric SMILES

CCCNC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C22H27N7O/c1-2-10-23-22(30)28-13-11-27(12-14-28)20-18-15-24-29(17-6-4-3-5-7-17)21(18)26-19(25-20)16-8-9-16/h3-7,15-16H,2,8-14H2,1H3,(H,23,30)