2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]quinazolin-4-olate

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]quinazolin-4-olate Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]quinazolin-4-olate CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-4-quinazolinolate IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]quinazolin-4-olate Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]quinazolin-4-olate Formula: C19H17N2O3S- MolecularWeight: 353.41488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C19H18N2O3S/c1-3-24-17-9-8-13(12(2)22)10-14(17)11-25-19-20-16-7-5-4-6-15(16)18(23)21-19/h4-10H,3,11H2,1-2H3,(H,20,21,23)/p-1