methyl 2-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate Openeye Name: methyl 2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate CAS Name: 2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(4-keto-8-methyl-1H-quinazolin-2-yl)methylthio]acetic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSCC(=O)OC

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSCC(=O)OC

InChI

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