ethyl 4-(3,4-dimethylphenyl)-5-methyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethylphenyl)-5-methyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethylphenyl)-5-methyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethylphenyl)-5-methyl-2-[[1-oxo-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethylphenyl)-5-methyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethylphenyl)-5-methyl-2-[[2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H25NO3S2 MolecularWeight: 439.5902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)C)C)C)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)C)C)C)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C24H25NO3S2/c1-5-28-24(27)22-21(18-12-11-15(2)16(3)13-18)17(4)30-23(22)25-20(26)14-29-19-9-7-6-8-10-19/h6-13H,5,14H2,1-4H3,(H,25,26)