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methyl 2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]ethanoate

methyl 2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]ethanoate

Systemtic Name:methyl 2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]ethanoate
Openeye Name:methyl 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]acetate
CAS Name:2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)thio]acetic acid methyl ester
IUPAC Name:methyl 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]acetate
Traditional Name:2-[(3-cyano-5-keto-7,8-dihydro-6H-quinolin-2-yl)thio]acetic acid methyl ester
Formula: C13H12N2O3S
MolecularWeight: 276.31098
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=C(C=C1C#N)C(=O)CCC2


Isomeric SMILES

COC(=O)CSC1=NC2=C(C=C1C#N)C(=O)CCC2


InChI

InChI=1S/C13H12N2O3S/c1-18-12(17)7-19-13-8(6-14)5-9-10(15-13)3-2-4-11(9)16/h5H,2-4,7H2,1H3


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