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

Systemtic Name: ethyl 4-ethyl-2-(2-ethylhexanoylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-(2-ethylhexanoylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-2-[(2-ethyl-1-oxohexyl)amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-(2-ethylhexanoylamino)-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-2-(2-ethylhexanoylamino)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NO3S/c1-6-10-11-13(7-2)16(20)19-17-15(18(21)22-9-4)14(8-3)12(5)23-17/h13H,6-11H2,1-5H3,(H,19,20)