2-[(4-tert-butylphenyl)methylsulfanyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-1H-quinazolin-4-one IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-1H-quinazolin-4-one Formula: C19H20N2OS MolecularWeight: 324.4399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C19H20N2OS/c1-19(2,3)14-10-8-13(9-11-14)12-23-18-20-16-7-5-4-6-15(16)17(22)21-18/h4-11H,12H2,1-3H3,(H,20,21,22)