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

Systemtic Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(isovalerylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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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)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O4S/c1-7-19(8-2)16(21)14-11(5)13(17(22)23-6)15(24-14)18-12(20)9-10(3)4/h10H,7-9H2,1-6H3,(H,18,20)