ethyl 2-[2-[(4-fluorophenyl)methylsulfanyl]ethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-[(4-fluorophenyl)methylsulfanyl]ethanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-[(4-fluorophenyl)methylsulfanyl]acetyl]amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(4-fluorophenyl)methylthio]-1-oxoethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-fluorophenyl)methylsulfanyl]acetyl]amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(4-fluorobenzyl)thio]acetyl]amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H19FN2O3S2 MolecularWeight: 430.515563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSCC2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSCC2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H19FN2O3S2/c1-2-27-20(26)19-18(15-6-4-3-5-7-15)24-21(29-19)23-17(25)13-28-12-14-8-10-16(22)11-9-14/h3-11H,2,12-13H2,1H3,(H,23,24,25)