2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-1H-quinazolin-4-one IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-1H-quinazolin-4-one Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC(=O)C3=CC=CC=C3N2)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC(=O)C3=CC=CC=C3N2)C)C(C)(C)C

InChI

InChI=1S/C21H24N2OS/c1-13-10-15(21(3,4)5)11-14(2)17(13)12-25-20-22-18-9-7-6-8-16(18)19(24)23-20/h6-11H,12H2,1-5H3,(H,22,23,24)