3-[6-(3,4-dimethoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1H-indole

Systemtic Name: 3-[6-(3,4-dimethoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1H-indole Openeye Name: 3-[6-(3,4-dimethoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1H-indole CAS Name: 3-[6-(3,4-dimethoxyphenyl)-2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-1H-indole IUPAC Name: 3-[6-(3,4-dimethoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1H-indole Traditional Name: 3-[6-(3,4-dimethoxyphenyl)-2-(4-methylpiperazino)pyrimidin-4-yl]-1H-indole Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=CC(=N2)C3=CNC4=CC=CC=C43)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CN1CCN(CC1)C2=NC(=CC(=N2)C3=CNC4=CC=CC=C43)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C25H27N5O2/c1-29-10-12-30(13-11-29)25-27-21(17-8-9-23(31-2)24(14-17)32-3)15-22(28-25)19-16-26-20-7-5-4-6-18(19)20/h4-9,14-16,26H,10-13H2,1-3H3