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

Systemtic Name: ethyl 4-(4-methylphenyl)-2-(undecanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(p-tolyl)-2-(undecanoylamino)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-(1-oxoundecylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylphenyl)-2-(undecanoylamino)thiophene-3-carboxylate Traditional Name: 4-(p-tolyl)-2-(undecanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C25H35NO3S MolecularWeight: 429.6153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C25H35NO3S/c1-4-6-7-8-9-10-11-12-13-22(27)26-24-23(25(28)29-5-2)21(18-30-24)20-16-14-19(3)15-17-20/h14-18H,4-13H2,1-3H3,(H,26,27)