ethyl 2-[(4-butylcyclohexyl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-butylcyclohexyl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-butylcyclohexanecarbonyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(4-butylcyclohexyl)-oxomethyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-butylcyclohexanecarbonyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(4-butylcyclohexanecarbonyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H35NO4S MolecularWeight: 457.6254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OCC)C(=O)OCC

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OCC)C(=O)OCC

InChI

InChI=1S/C26H35NO4S/c1-4-7-8-18-9-11-20(12-10-18)24(28)27-25-23(26(29)31-6-3)22(17-32-25)19-13-15-21(16-14-19)30-5-2/h13-18,20H,4-12H2,1-3H3,(H,27,28)