methyl 2-[(2,4-dichlorophenyl)carbonylamino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2,4-dichlorophenyl)carbonylamino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(2,4-dichlorobenzoyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-4-methyl-5-[oxo-(phenethylamino)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,4-dichlorobenzoyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[(2,4-dichlorobenzoyl)amino]-4-methyl-5-(phenethylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C23H20Cl2N2O4S MolecularWeight: 491.3869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H20Cl2N2O4S/c1-13-18(23(30)31-2)22(27-20(28)16-9-8-15(24)12-17(16)25)32-19(13)21(29)26-11-10-14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3,(H,26,29)(H,27,28)