ethyl 2-[4-(4-fluorophenyl)sulfonylbutanoylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[4-(4-fluorophenyl)sulfonylbutanoylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[4-(4-fluorophenyl)sulfonylbutanoylamino]thiazole-4-carboxylate CAS Name: 2-[[4-(4-fluorophenyl)sulfonyl-1-oxobutyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-fluorophenyl)sulfonylbutanoylamino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-(4-fluorophenyl)sulfonylbutanoylamino]thiazole-4-carboxylic acid ethyl ester Formula: C16H17FN2O5S2 MolecularWeight: 400.444983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(=O)CCCS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(=O)CCCS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN2O5S2/c1-2-24-15(21)13-10-25-16(18-13)19-14(20)4-3-9-26(22,23)12-7-5-11(17)6-8-12/h5-8,10H,2-4,9H2,1H3,(H,18,19,20)