methyl 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate Openeye Name: methyl 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate CAS Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methylthio]acetic acid methyl ester Formula: C12H11ClN2O3S MolecularWeight: 298.74534

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=NC(=O)C2=C(N1)C=C(C=C2)Cl

Isomeric SMILES

COC(=O)CSCC1=NC(=O)C2=C(N1)C=C(C=C2)Cl

InChI

InChI=1S/C12H11ClN2O3S/c1-18-11(16)6-19-5-10-14-9-4-7(13)2-3-8(9)12(17)15-10/h2-4H,5-6H2,1H3,(H,14,15,17)