ethyl 4-(2-chlorophenyl)-2-(2-pyridin-2-ylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-2-(2-pyridin-2-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-2-[[2-(2-pyridylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-2-[(2-pyridin-2-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[[2-(2-pyridylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H17ClN2O3S2 MolecularWeight: 432.94358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C20H17ClN2O3S2/c1-2-26-20(25)18-14(13-7-3-4-8-15(13)21)11-28-19(18)23-16(24)12-27-17-9-5-6-10-22-17/h3-11H,2,12H2,1H3,(H,23,24)