2-(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(3-methylbutyl)ethanamide Openeye Name: 2-(6-chloro-2-phenyl-quinazolin-4-yl)sulfanyl-N-isopentyl-acetamide CAS Name: 2-[(6-chloro-2-phenyl-4-quinazolinyl)thio]-N-(3-methylbutyl)acetamide IUPAC Name: 2-(6-chloro-2-phenylquinazolin-4-yl)sulfanyl-N-(3-methylbutyl)acetamide Traditional Name: 2-[(6-chloro-2-phenyl-quinazolin-4-yl)thio]-N-isoamyl-acetamide Formula: C21H22ClN3OS MolecularWeight: 399.93688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSC1=NC(=NC2=C1C=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)CSC1=NC(=NC2=C1C=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3OS/c1-14(2)10-11-23-19(26)13-27-21-17-12-16(22)8-9-18(17)24-20(25-21)15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3,(H,23,26)