ethyl 2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate Openeye Name: ethyl 2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate CAS Name: 2-[(4-oxo-1H-quinazolin-2-yl)methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methylthio]acetic acid ethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CCOC(=O)CSCC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C13H14N2O3S/c1-2-18-12(16)8-19-7-11-14-10-6-4-3-5-9(10)13(17)15-11/h3-6H,2,7-8H2,1H3,(H,14,15,17)