ethyl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-4-methyl-2-[(3-methyl-1-oxobutyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(isovalerylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC(C)C)C(=O)OCC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC(C)C)C(=O)OCC)C

InChI

InChI=1S/C18H28N2O4S/c1-7-20(8-2)17(22)15-12(6)14(18(23)24-9-3)16(25-15)19-13(21)10-11(4)5/h11H,7-10H2,1-6H3,(H,19,21)