(E)-3-(2-chloranyl-8-methyl-quinolin-3-yl)-2-(6-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=C(N=C4C(=CC=CC4=C3)C)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=NC2=O)/C(=C/C3=C(N=C4C(=CC=CC4=C3)C)Cl)/C#N

InChI

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