3-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]benzenecarbonitrile Openeye Name: 3-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]benzonitrile CAS Name: 3-[4-(4-methyl-1-piperazinyl)-2-quinazolinyl]benzonitrile IUPAC Name: 3-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]benzonitrile Traditional Name: 3-[4-(4-methylpiperazino)quinazolin-2-yl]benzonitrile Formula: C20H19N5 MolecularWeight: 329.39836

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H19N5/c1-24-9-11-25(12-10-24)20-17-7-2-3-8-18(17)22-19(23-20)16-6-4-5-15(13-16)14-21/h2-8,13H,9-12H2,1H3