ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(2-methylphenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(2-methylphenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(2-methylbenzoyl)amino]thiophene-2-carboxylate CAS Name: 4-[(methoxycarbonylamino)-oxomethyl]-3-methyl-5-[[(2-methylphenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(methoxycarbonylcarbamoyl)-3-methyl-5-[(2-methylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 4-(carbomethoxycarbamoyl)-3-methyl-5-(o-toluoylamino)thiophene-2-carboxylic acid ethyl ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=CC=C2C)C(=O)NC(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=CC=C2C)C(=O)NC(=O)OC)C

InChI

InChI=1S/C19H20N2O6S/c1-5-27-18(24)14-11(3)13(16(23)21-19(25)26-4)17(28-14)20-15(22)12-9-7-6-8-10(12)2/h6-9H,5H2,1-4H3,(H,20,22)(H,21,23,25)