ethyl 5-(dimethylcarbamoyl)-2-[2-[(2-ethylphenyl)amino]ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(dimethylcarbamoyl)-2-[2-[(2-ethylphenyl)amino]ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(dimethylcarbamoyl)-2-[[2-(2-ethylanilino)acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-2-[[2-(2-ethylanilino)-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(dimethylcarbamoyl)-2-[[2-(2-ethylanilino)acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-[[2-(2-ethylanilino)acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NCC(=O)NC2=C(C(=C(S2)C(=O)N(C)C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1NCC(=O)NC2=C(C(=C(S2)C(=O)N(C)C)C)C(=O)OCC

InChI

InChI=1S/C21H27N3O4S/c1-6-14-10-8-9-11-15(14)22-12-16(25)23-19-17(21(27)28-7-2)13(3)18(29-19)20(26)24(4)5/h8-11,22H,6-7,12H2,1-5H3,(H,23,25)