ethyl 5-ethyl-2-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(2-methylsulfanylanilino)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[2-(methylthio)anilino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(2-methylsulfanylanilino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[2-(methylthio)anilino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CNC2=CC=CC=C2SC)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CNC2=CC=CC=C2SC)C(=O)OCC

InChI

InChI=1S/C18H22N2O3S2/c1-4-12-10-13(18(22)23-5-2)17(25-12)20-16(21)11-19-14-8-6-7-9-15(14)24-3/h6-10,19H,4-5,11H2,1-3H3,(H,20,21)