ethyl 5-aminocarbonyl-4-methyl-2-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[2-[(2-methylsulfanylphenyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-[[2-(2-methylsulfanylanilino)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[2-[2-(methylthio)anilino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[[2-(2-methylsulfanylanilino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[2-[2-(methylthio)anilino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CNC2=CC=CC=C2SC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CNC2=CC=CC=C2SC

InChI

InChI=1S/C18H21N3O4S2/c1-4-25-18(24)14-10(2)15(16(19)23)27-17(14)21-13(22)9-20-11-7-5-6-8-12(11)26-3/h5-8,20H,4,9H2,1-3H3,(H2,19,23)(H,21,22)