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

Systemtic Name: propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(isovalerylamino)-4-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C19H30N2O4S MolecularWeight: 382.5175

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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)C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O4S/c1-8-21(9-2)18(23)16-13(7)15(19(24)25-12(5)6)17(26-16)20-14(22)10-11(3)4/h11-12H,8-10H2,1-7H3,(H,20,22)