2-[(E)-2-[3-(2-chloranylpyridin-3-yl)-4-oxidanylidene-quinazolin-2-yl]ethenyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-2-[3-(2-chloranylpyridin-3-yl)-4-oxidanylidene-quinazolin-2-yl]ethenyl]benzenecarbonitrile Openeye Name: 2-[(E)-2-[3-(2-chloro-3-pyridyl)-4-oxo-quinazolin-2-yl]vinyl]benzonitrile CAS Name: 2-[(E)-2-[3-(2-chloro-3-pyridinyl)-4-oxo-2-quinazolinyl]ethenyl]benzonitrile IUPAC Name: 2-[(E)-2-[3-(2-chloropyridin-3-yl)-4-oxoquinazolin-2-yl]ethenyl]benzonitrile Traditional Name: 2-[(E)-2-[3-(2-chloro-3-pyridyl)-4-keto-quinazolin-2-yl]vinyl]benzonitrile Formula: C22H13ClN4O MolecularWeight: 384.81782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC2=NC3=CC=CC=C3C(=O)N2C4=C(N=CC=C4)Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C2=NC3=CC=CC=C3C(=O)N2C4=C(N=CC=C4)Cl)C#N

InChI

InChI=1S/C22H13ClN4O/c23-21-19(10-5-13-25-21)27-20(12-11-15-6-1-2-7-16(15)14-24)26-18-9-4-3-8-17(18)22(27)28/h1-13H/b12-11+