2-[4-[(2-pyridin-3-ylquinazolin-4-yl)amino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(2-pyridin-3-ylquinazolin-4-yl)amino]phenyl]ethanenitrile Openeye Name: 2-[4-[[2-(3-pyridyl)quinazolin-4-yl]amino]phenyl]acetonitrile CAS Name: 2-[4-[[2-(3-pyridinyl)-4-quinazolinyl]amino]phenyl]acetonitrile IUPAC Name: 2-[4-[(2-pyridin-3-ylquinazolin-4-yl)amino]phenyl]acetonitrile Traditional Name: 2-[4-[[2-(3-pyridyl)quinazolin-4-yl]amino]phenyl]acetonitrile Formula: C21H15N5 MolecularWeight: 337.3773

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CN=CC=C3)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CN=CC=C3)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C21H15N5/c22-12-11-15-7-9-17(10-8-15)24-21-18-5-1-2-6-19(18)25-20(26-21)16-4-3-13-23-14-16/h1-10,13-14H,11H2,(H,24,25,26)