[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 5-ethyl-4-methyl-thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 5-ethyl-4-methyl-thiophene-2-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 5-ethyl-4-methyl-thiophene-2-carboxylate CAS Name: 5-ethyl-4-methyl-2-thiophenecarboxylic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 5-ethyl-4-methylthiophene-2-carboxylate Traditional Name: 5-ethyl-4-methyl-thiophene-2-carboxylic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C22H21NO3S2 MolecularWeight: 411.53704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C

InChI

InChI=1S/C22H21NO3S2/c1-3-18-15(2)13-20(28-18)22(25)26-14-21(24)23-17-11-7-8-12-19(17)27-16-9-5-4-6-10-16/h4-13H,3,14H2,1-2H3,(H,23,24)