methyl 2-[(6-azanyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-7-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(6-azanyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-7-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)sulfanyl]acetate CAS Name: 2-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)sulfanyl]acetate Traditional Name: 2-[(6-amino-2-keto-3,4-dihydro-1H-quinolin-7-yl)thio]acetic acid methyl ester Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=C2CCC(=O)NC2=C1)N

Isomeric SMILES

COC(=O)CSC1=C(C=C2CCC(=O)NC2=C1)N

InChI

InChI=1S/C12H14N2O3S/c1-17-12(16)6-18-10-5-9-7(4-8(10)13)2-3-11(15)14-9/h4-5H,2-3,6,13H2,1H3,(H,14,15)