(E)-3-(2-chloranylquinolin-3-yl)-2-(6,8-dimethyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2-chloranylquinolin-3-yl)-2-(6,8-dimethyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-chloro-3-quinolyl)-2-(6,8-dimethyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2-chloro-3-quinolinyl)-2-(6,8-dimethyl-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(2-chloroquinolin-3-yl)-2-(6,8-dimethyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-chloro-3-quinolyl)-2-(4-keto-6,8-dimethyl-1H-quinazolin-2-yl)acrylonitrile Formula: C22H15ClN4O MolecularWeight: 386.8337

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)N=C(N2)C(=CC3=CC4=CC=CC=C4N=C3Cl)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)N=C(N2)/C(=C/C3=CC4=CC=CC=C4N=C3Cl)/C#N)C

InChI

InChI=1S/C22H15ClN4O/c1-12-7-13(2)19-17(8-12)22(28)27-21(26-19)16(11-24)10-15-9-14-5-3-4-6-18(14)25-20(15)23/h3-10H,1-2H3,(H,26,27,28)/b16-10+