ethyl 2-[[5-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-[(2-chloro-6-fluoro-benzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(2-chloro-6-fluorobenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(2-chloro-6-fluoro-benzoyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C13H11ClFN3O3S2 MolecularWeight: 375.826143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=C(C=CC=C2Cl)F

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C13H11ClFN3O3S2/c1-2-21-9(19)6-22-13-18-17-12(23-13)16-11(20)10-7(14)4-3-5-8(10)15/h3-5H,2,6H2,1H3,(H,16,17,20)