ethyl 4-phenyl-2-(2-quinolin-2-ylsulfanylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-phenyl-2-(2-quinolin-2-ylsulfanylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[2-(2-quinolylsulfanyl)propanoylamino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(2-quinolinylthio)propyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-(2-quinolin-2-ylsulfanylpropanoylamino)thiophene-3-carboxylate Traditional Name: 4-phenyl-2-[2-(2-quinolylthio)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C25H22N2O3S2 MolecularWeight: 462.58378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C)SC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C)SC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H22N2O3S2/c1-3-30-25(29)22-19(17-9-5-4-6-10-17)15-31-24(22)27-23(28)16(2)32-21-14-13-18-11-7-8-12-20(18)26-21/h4-16H,3H2,1-2H3,(H,27,28)