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

Systemtic Name: (E)-3-(2-chloranyl-6,8-dimethyl-quinolin-3-yl)-2-(6-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-chloro-6,8-dimethyl-3-quinolyl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2-chloro-6,8-dimethyl-3-quinolinyl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(2-chloro-6,8-dimethylquinolin-3-yl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-chloro-6,8-dimethyl-3-quinolyl)-2-(4-keto-6-methyl-1H-quinazolin-2-yl)acrylonitrile Formula: C23H17ClN4O MolecularWeight: 400.86028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17ClN4O/c1-12-4-5-19-18(8-12)23(29)28-22(26-19)17(11-25)10-16-9-15-7-13(2)6-14(3)20(15)27-21(16)24/h4-10H,1-3H3,(H,26,28,29)/b17-10+