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

Systemtic Name: ethyl 5-[(3-fluorophenyl)carbonylamino]-4-(methoxycarbonylcarbamoyl)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(3-fluorobenzoyl)amino]-4-(methoxycarbonylcarbamoyl)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(3-fluorophenyl)-oxomethyl]amino]-4-[(methoxycarbonylamino)-oxomethyl]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-fluorobenzoyl)amino]-4-(methoxycarbonylcarbamoyl)-3-methylthiophene-2-carboxylate Traditional Name: 4-(carbomethoxycarbamoyl)-5-[(3-fluorobenzoyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H17FN2O6S MolecularWeight: 408.400783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17FN2O6S/c1-4-27-17(24)13-9(2)12(15(23)21-18(25)26-3)16(28-13)20-14(22)10-6-5-7-11(19)8-10/h5-8H,4H2,1-3H3,(H,20,22)(H,21,23,25)