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

Systemtic Name: ethyl 4-ethyl-2-(hexanoylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-(hexanoylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-(1-oxohexylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-(hexanoylamino)-5-methylthiophene-3-carboxylate Traditional Name: 2-(caproylamino)-4-ethyl-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H25NO3S MolecularWeight: 311.4396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO3S/c1-5-8-9-10-13(18)17-15-14(16(19)20-7-3)12(6-2)11(4)21-15/h5-10H2,1-4H3,(H,17,18)