methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate CAS Name: 5-[(4-ethoxycarbonylanilino)-oxomethyl]-4-methyl-2-(1-oxopropylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-4-methyl-2-(propanoylamino)thiophene-3-carboxylate Traditional Name: 5-[(4-carbethoxyphenyl)carbamoyl]-4-methyl-2-propionamido-thiophene-3-carboxylic acid methyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=C(C=C2)C(=O)OCC)C)C(=O)OC

Isomeric SMILES

CCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=C(C=C2)C(=O)OCC)C)C(=O)OC

InChI

InChI=1S/C20H22N2O6S/c1-5-14(23)22-18-15(20(26)27-4)11(3)16(29-18)17(24)21-13-9-7-12(8-10-13)19(25)28-6-2/h7-10H,5-6H2,1-4H3,(H,21,24)(H,22,23)