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

Systemtic Name: ethyl 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN2O3S/c1-2-19-12(17)7-20-6-11-15-10-5-8(14)3-4-9(10)13(18)16-11/h3-5H,2,6-7H2,1H3,(H,15,16,18)