4-[3-(4-methylpiperazin-1-yl)propyl]-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine

Systemtic Name: 4-[3-(4-methylpiperazin-1-yl)propyl]-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Openeye Name: 4-[3-(4-methylpiperazin-1-yl)propyl]-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine CAS Name: 4-[3-(4-methyl-1-piperazinyl)propyl]-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)-2-pyrimidinamine IUPAC Name: 4-[3-(4-methylpiperazin-1-yl)propyl]-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Traditional Name: [4-[3-(4-methylpiperazino)propyl]-6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]amine Formula: C19H25N7 MolecularWeight: 351.4487

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCC2=NC(=NC(=C2)C3=CNC4=C3C=CC=N4)N

Isomeric SMILES

CN1CCN(CC1)CCCC2=NC(=NC(=C2)C3=CNC4=C3C=CC=N4)N

InChI

InChI=1S/C19H25N7/c1-25-8-10-26(11-9-25)7-3-4-14-12-17(24-19(20)23-14)16-13-22-18-15(16)5-2-6-21-18/h2,5-6,12-13H,3-4,7-11H2,1H3,(H,21,22)(H2,20,23,24)