2-[(4-tert-butylphenyl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[(4-tert-butylphenyl)thio]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[(4-tert-butylphenyl)sulfanylmethyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[(4-tert-butylphenyl)thio]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O3S/c1-21(2,3)13-6-8-14(9-7-13)27-12-19-22-16-11-18(26-5)17(25-4)10-15(16)20(24)23-19/h6-11H,12H2,1-5H3,(H,22,23,24)