1-(4-tert-butylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(4-tert-butylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(4-tert-butylphenyl)-2-[(2-methyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(4-tert-butylphenyl)-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(4-tert-butylphenyl)-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C21H22N2OS MolecularWeight: 350.47718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H22N2OS/c1-14-22-18-8-6-5-7-17(18)20(23-14)25-13-19(24)15-9-11-16(12-10-15)21(2,3)4/h5-12H,13H2,1-4H3