ethyl 2-[(4-butylcyclohexyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-butylcyclohexyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[(4-butylcyclohexanecarbonyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[(4-butylcyclohexyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[(4-butylcyclohexanecarbonyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[(4-butylcyclohexanecarbonyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H31NO4S MolecularWeight: 393.54014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC

InChI

InChI=1S/C21H31NO4S/c1-5-7-8-15-9-11-16(12-10-15)19(24)22-20-17(21(25)26-6-2)13(3)18(27-20)14(4)23/h15-16H,5-12H2,1-4H3,(H,22,24)