ethyl 5-(2-ethylhexanoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-(2-ethylhexanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-(2-ethylhexanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-ethylhexanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(2-ethylhexanoylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C16H25NO3S MolecularWeight: 311.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(S1)C(=O)OCC)C

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(S1)C(=O)OCC)C

InChI

InChI=1S/C16H25NO3S/c1-5-8-9-12(6-2)15(18)17-13-10-11(4)14(21-13)16(19)20-7-3/h10,12H,5-9H2,1-4H3,(H,17,18)