2-[(6-methoxy-2-methyl-4-oxidanylidene-quinazolin-3-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(6-methoxy-2-methyl-4-oxidanylidene-quinazolin-3-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(6-methoxy-2-methyl-4-oxo-quinazolin-3-yl)methylsulfanyl]acetic acid CAS Name: 2-[(6-methoxy-2-methyl-4-oxo-3-quinazolinyl)methylthio]acetic acid IUPAC Name: 2-[(6-methoxy-2-methyl-4-oxoquinazolin-3-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(4-keto-6-methoxy-2-methyl-quinazolin-3-yl)methylthio]acetic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=O)N1CSCC(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=O)N1CSCC(=O)O

InChI

InChI=1S/C13H14N2O4S/c1-8-14-11-4-3-9(19-2)5-10(11)13(18)15(8)7-20-6-12(16)17/h3-5H,6-7H2,1-2H3,(H,16,17)