2-[2-[[3-aminocarbonyl-4-(4-fluorophenyl)-5-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[[3-aminocarbonyl-4-(4-fluorophenyl)-5-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[[3-carbamoyl-4-(4-fluorophenyl)-5-methyl-2-thienyl]amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[[3-carbamoyl-4-(4-fluorophenyl)-5-methyl-2-thiophenyl]amino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[[3-carbamoyl-4-(4-fluorophenyl)-5-methylthiophen-2-yl]amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[[3-carbamoyl-4-(4-fluorophenyl)-5-methyl-2-thienyl]amino]-2-keto-ethyl]thio]acetic acid Formula: C16H15FN2O4S2 MolecularWeight: 382.429703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CSCC(=O)O)C(=O)N)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CSCC(=O)O)C(=O)N)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H15FN2O4S2/c1-8-13(9-2-4-10(17)5-3-9)14(15(18)23)16(25-8)19-11(20)6-24-7-12(21)22/h2-5H,6-7H2,1H3,(H2,18,23)(H,19,20)(H,21,22)