methyl 2-[3-(4-fluorophenyl)propanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[3-(4-fluorophenyl)propanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[3-(4-fluorophenyl)propanoylamino]thiazole-5-carboxylate CAS Name: 2-[[3-(4-fluorophenyl)-1-oxopropyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-fluorophenyl)propanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(4-fluorophenyl)propanoylamino]thiazole-5-carboxylic acid methyl ester Formula: C14H13FN2O3S MolecularWeight: 308.328023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)CCC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)CCC2=CC=C(C=C2)F

InChI

InChI=1S/C14H13FN2O3S/c1-20-13(19)11-8-16-14(21-11)17-12(18)7-4-9-2-5-10(15)6-3-9/h2-3,5-6,8H,4,7H2,1H3,(H,16,17,18)