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

Systemtic Name: 3-[(2-pyridin-3-ylquinazolin-4-yl)amino]propanenitrile Openeye Name: 3-[[2-(3-pyridyl)quinazolin-4-yl]amino]propanenitrile CAS Name: 3-[[2-(3-pyridinyl)-4-quinazolinyl]amino]propanenitrile IUPAC Name: 3-[(2-pyridin-3-ylquinazolin-4-yl)amino]propanenitrile Traditional Name: 3-[[2-(3-pyridyl)quinazolin-4-yl]amino]propionitrile Formula: C16H13N5 MolecularWeight: 275.30792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N5/c17-8-4-10-19-16-13-6-1-2-7-14(13)20-15(21-16)12-5-3-9-18-11-12/h1-3,5-7,9,11H,4,10H2,(H,19,20,21)