ethyl 4-(4-fluorophenyl)-2-(furan-2-ylmethylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)-2-(furan-2-ylmethylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)-2-(2-furylmethylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-[[(2-furanylmethylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-2-(furan-2-ylmethylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-(2-furfurylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C19H17FN2O3S2 MolecularWeight: 404.478283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=S)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=S)NCC3=CC=CO3

InChI

InChI=1S/C19H17FN2O3S2/c1-2-24-18(23)16-15(12-5-7-13(20)8-6-12)11-27-17(16)22-19(26)21-10-14-4-3-9-25-14/h3-9,11H,2,10H2,1H3,(H2,21,22,26)