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

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[(2-ethyl-1-oxohexyl)amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-(2-ethylhexanoylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H32N2O4S MolecularWeight: 396.54408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)N(CC)CC)C)C(=O)OC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)N(CC)CC)C)C(=O)OC

InChI

InChI=1S/C20H32N2O4S/c1-7-11-12-14(8-2)17(23)21-18-15(20(25)26-6)13(5)16(27-18)19(24)22(9-3)10-4/h14H,7-12H2,1-6H3,(H,21,23)