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

Systemtic Name: methyl 4-(4-methylphenyl)-2-(undecanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(p-tolyl)-2-(undecanoylamino)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-(1-oxoundecylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-(undecanoylamino)thiophene-3-carboxylate Traditional Name: 4-(p-tolyl)-2-(undecanoylamino)thiophene-3-carboxylic acid methyl ester Formula: C24H33NO3S MolecularWeight: 415.58872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33NO3S/c1-4-5-6-7-8-9-10-11-12-21(26)25-23-22(24(27)28-3)20(17-29-23)19-15-13-18(2)14-16-19/h13-17H,4-12H2,1-3H3,(H,25,26)