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

Systemtic Name: ethyl 2-[(4-butylcyclohexyl)carbonylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-butylcyclohexanecarbonyl)amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(4-butylcyclohexyl)-oxomethyl]amino]-4-(3,4-dimethylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-butylcyclohexanecarbonyl)amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(4-butylcyclohexanecarbonyl)amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H35NO3S MolecularWeight: 441.626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35NO3S/c1-5-7-8-19-10-13-20(14-11-19)24(28)27-25-23(26(29)30-6-2)22(16-31-25)21-12-9-17(3)18(4)15-21/h9,12,15-16,19-20H,5-8,10-11,13-14H2,1-4H3,(H,27,28)