4-[[[2,4-bis(azanyl)quinazolin-6-yl]amino]methyl]-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-[[[2,4-bis(azanyl)quinazolin-6-yl]amino]methyl]-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-[[(2,4-diaminoquinazolin-6-yl)amino]methyl]-N-(2-pyridylmethyl)benzamide CAS Name: 4-[[(2,4-diamino-6-quinazolinyl)amino]methyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-[[(2,4-diaminoquinazolin-6-yl)amino]methyl]-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-[[(2,4-diaminoquinazolin-6-yl)amino]methyl]-N-(2-pyridylmethyl)benzamide Formula: C22H21N7O MolecularWeight: 399.44844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)C2=CC=C(C=C2)CNC3=CC4=C(C=C3)N=C(N=C4N)N

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)C2=CC=C(C=C2)CNC3=CC4=C(C=C3)N=C(N=C4N)N

InChI

InChI=1S/C22H21N7O/c23-20-18-11-16(8-9-19(18)28-22(24)29-20)26-12-14-4-6-15(7-5-14)21(30)27-13-17-3-1-2-10-25-17/h1-11,26H,12-13H2,(H,27,30)(H4,23,24,28,29)