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

Systemtic Name: 3-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanyl-N-(4-phenylphenyl)propanamide Openeye Name: 3-(6-chloro-4-phenyl-quinazolin-2-yl)sulfanyl-N-(4-phenylphenyl)propanamide CAS Name: 3-[(6-chloro-4-phenyl-2-quinazolinyl)thio]-N-(4-phenylphenyl)propanamide IUPAC Name: 3-(6-chloro-4-phenylquinazolin-2-yl)sulfanyl-N-(4-phenylphenyl)propanamide Traditional Name: 3-[(6-chloro-4-phenyl-quinazolin-2-yl)thio]-N-(4-phenylphenyl)propionamide Formula: C29H22ClN3OS MolecularWeight: 496.02248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)CCSC3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)CCSC3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C29H22ClN3OS/c30-23-13-16-26-25(19-23)28(22-9-5-2-6-10-22)33-29(32-26)35-18-17-27(34)31-24-14-11-21(12-15-24)20-7-3-1-4-8-20/h1-16,19H,17-18H2,(H,31,34)