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

Systemtic Name: (4-butylphenyl)-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (4-butylphenyl)-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (4-butylphenyl)-[4-(3-methyl-1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-butylphenyl)-[4-(3-methyl-1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (4-butylphenyl)-[4-(3-methyl-1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methanone Formula: C30H36N6O MolecularWeight: 496.64644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C(=NN4C5=CC=CC=C5)C)CCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C(=NN4C5=CC=CC=C5)C)CCC

InChI

InChI=1S/C30H36N6O/c1-4-6-11-23-14-16-24(17-15-23)30(37)35-20-18-34(19-21-35)28-27-22(3)33-36(25-12-8-7-9-13-25)29(27)32-26(31-28)10-5-2/h7-9,12-17H,4-6,10-11,18-21H2,1-3H3