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

Systemtic Name: 3-(2-chloranyl-6-phenyl-quinolin-3-yl)-2-(6-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: 3-(2-chloro-6-phenyl-3-quinolyl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: 3-(2-chloro-6-phenyl-3-quinolinyl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: 3-(2-chloro-6-phenylquinolin-3-yl)-2-(6-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: 3-(2-chloro-6-phenyl-3-quinolyl)-2-(4-keto-6-methyl-1H-quinazolin-2-yl)acrylonitrile Formula: C27H17ClN4O MolecularWeight: 448.90308

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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)C5=CC=CC=C5)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=C(N=C4C=CC(=CC4=C3)C5=CC=CC=C5)Cl)C#N

InChI

InChI=1S/C27H17ClN4O/c1-16-7-9-24-22(11-16)27(33)32-26(31-24)21(15-29)14-20-13-19-12-18(17-5-3-2-4-6-17)8-10-23(19)30-25(20)28/h2-14H,1H3,(H,31,32,33)