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

Systemtic Name: 4-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide Openeye Name: 4-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide CAS Name: 4-(6-ethyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-N-propyl-1-piperazinecarboxamide IUPAC Name: 4-(6-ethyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)-N-propylpiperazine-1-carboxamide Traditional Name: 4-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carboxamide Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N7O/c1-3-10-22-21(29)27-13-11-26(12-14-27)19-17-15-23-28(16-8-6-5-7-9-16)20(17)25-18(4-2)24-19/h5-9,15H,3-4,10-14H2,1-2H3,(H,22,29)