ethyl 4,5-dimethyl-2-(2-quinolin-2-ylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-(2-quinolin-2-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-(2-quinolylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(2-quinolinylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(2-quinolin-2-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(2-quinolylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H20N2O3S2/c1-4-25-20(24)18-12(2)13(3)27-19(18)22-16(23)11-26-17-10-9-14-7-5-6-8-15(14)21-17/h5-10H,4,11H2,1-3H3,(H,22,23)