ethyl 5-methyl-4-(4-methylphenyl)-2-[2-(phenethylamino)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-4-(4-methylphenyl)-2-[2-(phenethylamino)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-2-[[2-(phenethylamino)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-methylphenyl)-2-[[1-oxo-2-(phenethylamino)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(4-methylphenyl)-2-[[2-(phenethylamino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-(phenethylamino)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CNCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CNCCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3S/c1-4-30-25(29)23-22(20-12-10-17(2)11-13-20)18(3)31-24(23)27-21(28)16-26-15-14-19-8-6-5-7-9-19/h5-13,26H,4,14-16H2,1-3H3,(H,27,28)