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

Systemtic Name: ethyl 4-phenyl-2-(2-quinolin-2-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[2-(2-quinolylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(2-quinolinylthio)ethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[(2-quinolin-2-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-phenyl-2-[[2-(2-quinolylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H20N2O3S2 MolecularWeight: 448.5572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H20N2O3S2/c1-2-29-24(28)22-18(16-8-4-3-5-9-16)14-31-23(22)26-20(27)15-30-21-13-12-17-10-6-7-11-19(17)25-21/h3-14H,2,15H2,1H3,(H,26,27)