N-(2-methylquinolin-4-yl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-methylquinolin-4-yl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2-methyl-4-quinolyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(2-methyl-4-quinolinyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2-methylquinolin-4-yl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]-N-(2-methyl-4-quinolyl)propionamide Formula: C27H22N4O2S MolecularWeight: 466.55418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O2S/c1-17-16-24(20-12-6-8-14-22(20)28-17)29-25(32)18(2)34-27-30-23-15-9-7-13-21(23)26(33)31(27)19-10-4-3-5-11-19/h3-16,18H,1-2H3,(H,28,29,32)