2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,5-dimethoxyphenyl)ethanone

Systemtic Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,5-dimethoxyphenyl)ethanone Openeye Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,5-dimethoxyphenyl)ethanone CAS Name: 2-[(2-tert-butyl-4-quinazolinyl)thio]-1-(2,5-dimethoxyphenyl)ethanone IUPAC Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,5-dimethoxyphenyl)ethanone Traditional Name: 2-[(2-tert-butylquinazolin-4-yl)thio]-1-(2,5-dimethoxyphenyl)ethanone Formula: C22H24N2O3S MolecularWeight: 396.50256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC(C)(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C22H24N2O3S/c1-22(2,3)21-23-17-9-7-6-8-15(17)20(24-21)28-13-18(25)16-12-14(26-4)10-11-19(16)27-5/h6-12H,13H2,1-5H3