N-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-ethoxy-1-ethyl-pyrazole-4-carboxamide

Systemtic Name: N-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-ethoxy-1-ethyl-pyrazole-4-carboxamide Openeye Name: N-[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-ethoxy-1-ethyl-pyrazole-4-carboxamide CAS Name: N-[5-[(2-chloro-6-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-3-ethoxy-1-ethyl-4-pyrazolecarboxamide IUPAC Name: N-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-ethoxy-1-ethylpyrazole-4-carboxamide Traditional Name: N-[5-[(2-chloro-6-fluoro-benzyl)thio]-1,3,4-thiadiazol-2-yl]-3-ethoxy-1-ethyl-pyrazole-4-carboxamide Formula: C17H17ClFN5O2S2 MolecularWeight: 441.930583

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)OCC)C(=O)NC2=NN=C(S2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCN1C=C(C(=N1)OCC)C(=O)NC2=NN=C(S2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H17ClFN5O2S2/c1-3-24-8-10(15(23-24)26-4-2)14(25)20-16-21-22-17(28-16)27-9-11-12(18)6-5-7-13(11)19/h5-8H,3-4,9H2,1-2H3,(H,20,21,25)