N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-(4-cyano-5-methylsulfanyl-3-thiophen-2-yl-pyrazol-1-yl)ethanamide

Systemtic Name: N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-(4-cyano-5-methylsulfanyl-3-thiophen-2-yl-pyrazol-1-yl)ethanamide Openeye Name: N-[(E)-(2-chloro-6-fluoro-phenyl)methyleneamino]-2-[4-cyano-5-methylsulfanyl-3-(2-thienyl)pyrazol-1-yl]acetamide CAS Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-2-[4-cyano-5-(methylthio)-3-thiophen-2-yl-1-pyrazolyl]acetamide IUPAC Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-2-(4-cyano-5-methylsulfanyl-3-thiophen-2-ylpyrazol-1-yl)acetamide Traditional Name: N-[(E)-(2-chloro-6-fluoro-benzylidene)amino]-2-[4-cyano-5-(methylthio)-3-(2-thienyl)pyrazol-1-yl]acetamide Formula: C18H13ClFN5OS2 MolecularWeight: 433.910123

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NN1CC(=O)NN=CC2=C(C=CC=C2Cl)F)C3=CC=CS3)C#N

Isomeric SMILES

CSC1=C(C(=NN1CC(=O)N/N=C/C2=C(C=CC=C2Cl)F)C3=CC=CS3)C#N

InChI

InChI=1S/C18H13ClFN5OS2/c1-27-18-11(8-21)17(15-6-3-7-28-15)24-25(18)10-16(26)23-22-9-12-13(19)4-2-5-14(12)20/h2-7,9H,10H2,1H3,(H,23,26)/b22-9+