2-[phenyl-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinoline

Systemtic Name: 2-[phenyl-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinoline Openeye Name: 2-[phenyl-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinoline CAS Name: 2-[phenyl-[4-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]quinoline IUPAC Name: 2-[phenyl-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinoline Traditional Name: 2-[phenyl-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]quinoline Formula: C31H27N7 MolecularWeight: 497.59298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(C5=CC=CC=C5)C6=NC7=CC=CC=C7C=C6

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(C5=CC=CC=C5)C6=NC7=CC=CC=C7C=C6

InChI

InChI=1S/C31H27N7/c1-3-10-24(11-4-1)29(28-16-15-23-9-7-8-14-27(23)35-28)36-17-19-37(20-18-36)30-26-21-34-38(31(26)33-22-32-30)25-12-5-2-6-13-25/h1-16,21-22,29H,17-20H2