ethyl 2-(3-cyclohexylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(3-cyclohexylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(3-cyclohexylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[(3-cyclohexyl-1-oxopropyl)amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-cyclohexylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-(3-cyclohexylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H29NO3S MolecularWeight: 399.54626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CCC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C23H29NO3S/c1-3-27-23(26)21-19(18-12-9-16(2)10-13-18)15-28-22(21)24-20(25)14-11-17-7-5-4-6-8-17/h9-10,12-13,15,17H,3-8,11,14H2,1-2H3,(H,24,25)