ethyl 5-aminocarbonyl-4-methyl-2-(octanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-(octanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-(octanoylamino)thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-(1-oxooctylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-(octanoylamino)thiophene-3-carboxylate Traditional Name: 2-(caprylylamino)-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)N)C)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)N)C)C(=O)OCC

InChI

InChI=1S/C17H26N2O4S/c1-4-6-7-8-9-10-12(20)19-16-13(17(22)23-5-2)11(3)14(24-16)15(18)21/h4-10H2,1-3H3,(H2,18,21)(H,19,20)