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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC2=NC(=O)C3=CC=CC=C3N2

InChI

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