7-[4-(4-methylpiperazin-1-yl)cyclohexyl]-5-[4-(phenylmethyl)phenyl]-7H-pyrrolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 7-[4-(4-methylpiperazin-1-yl)cyclohexyl]-5-[4-(phenylmethyl)phenyl]-7H-pyrrolo[3,4-d]pyrimidin-4-amine Openeye Name: 5-(4-benzylphenyl)-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]-7H-pyrrolo[3,4-d]pyrimidin-4-amine CAS Name: 7-[4-(4-methyl-1-piperazinyl)cyclohexyl]-5-[4-(phenylmethyl)phenyl]-7H-pyrrolo[3,4-d]pyrimidin-4-amine IUPAC Name: 5-(4-benzylphenyl)-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]-7H-pyrrolo[3,4-d]pyrimidin-4-amine Traditional Name: [5-(4-benzylphenyl)-7-[4-(4-methylpiperazino)cyclohexyl]-7H-pyrrolo[3,4-d]pyrimidin-4-yl]amine Formula: C30H36N6 MolecularWeight: 480.64704

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCC(CC2)C3C4=C(C(=N3)C5=CC=C(C=C5)CC6=CC=CC=C6)C(=NC=N4)N

Isomeric SMILES

CN1CCN(CC1)C2CCC(CC2)C3C4=C(C(=N3)C5=CC=C(C=C5)CC6=CC=CC=C6)C(=NC=N4)N

InChI

InChI=1S/C30H36N6/c1-35-15-17-36(18-16-35)25-13-11-24(12-14-25)28-29-26(30(31)33-20-32-29)27(34-28)23-9-7-22(8-10-23)19-21-5-3-2-4-6-21/h2-10,20,24-25,28H,11-19H2,1H3,(H2,31,32,33)