methyl 2-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(2-ethoxy-2-oxo-acetyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[(2-ethoxy-1,2-dioxoethyl)amino]-4-methyl-5-[oxo-(phenethylamino)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-ethoxy-2-oxoacetyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-(ethoxalylamino)-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=C(C(=C(S1)C(=O)NCCC2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

CCOC(=O)C(=O)NC1=C(C(=C(S1)C(=O)NCCC2=CC=CC=C2)C)C(=O)OC

InChI

InChI=1S/C20H22N2O6S/c1-4-28-20(26)17(24)22-18-14(19(25)27-3)12(2)15(29-18)16(23)21-11-10-13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3,(H,21,23)(H,22,24)