3-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanyl-N-(2-cyanophenyl)propanamide

Systemtic Name: 3-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanyl-N-(2-cyanophenyl)propanamide Openeye Name: 3-(6-chloro-4-phenyl-quinazolin-2-yl)sulfanyl-N-(2-cyanophenyl)propanamide CAS Name: 3-[(6-chloro-4-phenyl-2-quinazolinyl)thio]-N-(2-cyanophenyl)propanamide IUPAC Name: 3-(6-chloro-4-phenylquinazolin-2-yl)sulfanyl-N-(2-cyanophenyl)propanamide Traditional Name: 3-[(6-chloro-4-phenyl-quinazolin-2-yl)thio]-N-(2-cyanophenyl)propionamide Formula: C24H17ClN4OS MolecularWeight: 444.93598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCCC(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCCC(=O)NC4=CC=CC=C4C#N

InChI

InChI=1S/C24H17ClN4OS/c25-18-10-11-21-19(14-18)23(16-6-2-1-3-7-16)29-24(28-21)31-13-12-22(30)27-20-9-5-4-8-17(20)15-26/h1-11,14H,12-13H2,(H,27,30)