2-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(4-oxo-3-phenyl-quinazolin-2-yl)methylsulfanyl]acetic acid CAS Name: 2-[(4-oxo-3-phenyl-2-quinazolinyl)methylthio]acetic acid IUPAC Name: 2-[(4-oxo-3-phenylquinazolin-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(4-keto-3-phenyl-quinazolin-2-yl)methylthio]acetic acid Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSCC(=O)O

InChI

InChI=1S/C17H14N2O3S/c20-16(21)11-23-10-15-18-14-9-5-4-8-13(14)17(22)19(15)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)