ethyl 5-ethyl-2-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(p-tolylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(p-tolylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CSC2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CSC2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C18H21NO3S2/c1-4-13-10-15(18(21)22-5-2)17(24-13)19-16(20)11-23-14-8-6-12(3)7-9-14/h6-10H,4-5,11H2,1-3H3,(H,19,20)