2-[[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]methylamino]pyridine-3-carbonitrile

Systemtic Name: 2-[[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]methylamino]pyridine-3-carbonitrile Openeye Name: 2-[[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]methylamino]pyridine-3-carbonitrile CAS Name: 2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]methylamino]-3-pyridinecarbonitrile IUPAC Name: 2-[[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]methylamino]pyridine-3-carbonitrile Traditional Name: 2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]methylamino]nicotinonitrile Formula: C21H14ClN5O MolecularWeight: 387.82176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CNC3=C(C=CC=N3)C#N)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CNC3=C(C=CC=N3)C#N)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H14ClN5O/c22-16-8-2-4-10-18(16)27-19(13-25-20-14(12-23)6-5-11-24-20)26-17-9-3-1-7-15(17)21(27)28/h1-11H,13H2,(H,24,25)