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

Systemtic Name: N-(3-chlorophenyl)-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-(1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-4-(1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxamide Formula: C25H26ClN7O MolecularWeight: 475.97324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)C(=O)NC5=CC(=CC=C5)Cl

Isomeric SMILES

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H26ClN7O/c1-2-7-22-29-23(21-17-27-33(24(21)30-22)20-10-4-3-5-11-20)31-12-14-32(15-13-31)25(34)28-19-9-6-8-18(26)16-19/h3-6,8-11,16-17H,2,7,12-15H2,1H3,(H,28,34)