2-[2-(6-chloranyl-4-cyclopropyl-2-oxidanylidene-1,3-dihydroquinazolin-4-yl)ethynyl]benzenecarbonitrile

Systemtic Name: 2-[2-(6-chloranyl-4-cyclopropyl-2-oxidanylidene-1,3-dihydroquinazolin-4-yl)ethynyl]benzenecarbonitrile Openeye Name: 2-[2-(6-chloro-4-cyclopropyl-2-oxo-1,3-dihydroquinazolin-4-yl)ethynyl]benzonitrile CAS Name: 2-[2-(6-chloro-4-cyclopropyl-2-oxo-1,3-dihydroquinazolin-4-yl)ethynyl]benzonitrile IUPAC Name: 2-[2-(6-chloro-4-cyclopropyl-2-oxo-1,3-dihydroquinazolin-4-yl)ethynyl]benzonitrile Traditional Name: 2-[2-(6-chloro-4-cyclopropyl-2-keto-1,3-dihydroquinazolin-4-yl)ethynyl]benzonitrile Formula: C20H14ClN3O MolecularWeight: 347.79766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2(C3=C(C=CC(=C3)Cl)NC(=O)N2)C#CC4=CC=CC=C4C#N

Isomeric SMILES

C1CC1C2(C3=C(C=CC(=C3)Cl)NC(=O)N2)C#CC4=CC=CC=C4C#N

InChI

InChI=1S/C20H14ClN3O/c21-16-7-8-18-17(11-16)20(15-5-6-15,24-19(25)23-18)10-9-13-3-1-2-4-14(13)12-22/h1-4,7-8,11,15H,5-6H2,(H2,23,24,25)