ethyl 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoate

Systemtic Name: ethyl 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoate Openeye Name: ethyl 2-[[3-cyano-4-(2-thienyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]propanoate CAS Name: 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoate Traditional Name: 2-[[3-cyano-4-(2-thienyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]propionic acid ethyl ester Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC2=C(CCCC2)C(=C1C#N)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C(C)SC1=NC2=C(CCCC2)C(=C1C#N)C3=CC=CS3

InChI

InChI=1S/C19H20N2O2S2/c1-3-23-19(22)12(2)25-18-14(11-20)17(16-9-6-10-24-16)13-7-4-5-8-15(13)21-18/h6,9-10,12H,3-5,7-8H2,1-2H3