ethyl 2-[[(4-fluorophenyl)sulfonyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(4-fluorophenyl)sulfonyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-fluorophenyl)sulfonyl-propyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(4-fluorophenyl)sulfonyl-propylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-fluorophenyl)sulfonyl-propylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-fluorophenyl)sulfonyl-propyl-amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C16H19FN2O4S2 MolecularWeight: 386.461463

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=CS1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCCN(CC1=NC(=CS1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN2O4S2/c1-3-9-19(25(21,22)13-7-5-12(17)6-8-13)10-15-18-14(11-24-15)16(20)23-4-2/h5-8,11H,3-4,9-10H2,1-2H3