(4-butoxyphenyl)-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-(1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-(1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methanone Formula: C29H34N6O2 MolecularWeight: 498.61926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)CCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)CCC

InChI

InChI=1S/C29H34N6O2/c1-3-5-20-37-24-14-12-22(13-15-24)29(36)34-18-16-33(17-19-34)27-25-21-30-35(23-10-7-6-8-11-23)28(25)32-26(31-27)9-4-2/h6-8,10-15,21H,3-5,9,16-20H2,1-2H3