ethyl 2-[(7-azanyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(7-azanyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(7-amino-3-oxo-4H-1,4-benzoxazin-6-yl)sulfanyl]acetate CAS Name: 2-[(7-amino-3-oxo-4H-1,4-benzoxazin-6-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(7-amino-3-oxo-4H-1,4-benzoxazin-6-yl)sulfanyl]acetate Traditional Name: 2-[(7-amino-3-keto-4H-1,4-benzoxazin-6-yl)thio]acetic acid ethyl ester Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C2C(=C1)NC(=O)CO2)N

Isomeric SMILES

CCOC(=O)CSC1=C(C=C2C(=C1)NC(=O)CO2)N

InChI

InChI=1S/C12H14N2O4S/c1-2-17-12(16)6-19-10-4-8-9(3-7(10)13)18-5-11(15)14-8/h3-4H,2,5-6,13H2,1H3,(H,14,15)