ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxole-5-carbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-5-[(2-fluoroanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxole-5-carbonylamino)-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 5-[(2-fluorophenyl)carbamoyl]-4-methyl-2-(piperonyloylamino)thiophene-3-carboxylic acid ethyl ester Formula: C23H19FN2O6S MolecularWeight: 470.470163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H19FN2O6S/c1-3-30-23(29)18-12(2)19(21(28)25-15-7-5-4-6-14(15)24)33-22(18)26-20(27)13-8-9-16-17(10-13)32-11-31-16/h4-10H,3,11H2,1-2H3,(H,25,28)(H,26,27)