ethyl 4-aminocarbonyl-5-[2-(4-fluorophenyl)sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-5-[2-(4-fluorophenyl)sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-carbamoyl-5-[[2-(4-fluorophenyl)sulfanylacetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-carbamoyl-5-[[2-[(4-fluorophenyl)thio]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-5-[[2-(4-fluorophenyl)sulfanylacetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-carbamoyl-5-[[2-[(4-fluorophenyl)thio]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H17FN2O4S2 MolecularWeight: 396.456283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=CC=C(C=C2)F)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=CC=C(C=C2)F)C(=O)N)C

InChI

InChI=1S/C17H17FN2O4S2/c1-3-24-17(23)14-9(2)13(15(19)22)16(26-14)20-12(21)8-25-11-6-4-10(18)5-7-11/h4-7H,3,8H2,1-2H3,(H2,19,22)(H,20,21)