2-chloranyl-N-[[5-ethylsulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-6-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-[[5-ethylsulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-6-fluoranyl-benzamide Openeye Name: 2-chloro-N-[[5-ethylsulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-6-fluoro-benzamide CAS Name: 2-chloro-N-[[5-(ethylthio)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-6-fluorobenzamide IUPAC Name: 2-chloro-N-[[5-ethylsulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-6-fluorobenzamide Traditional Name: 2-chloro-N-[[5-(ethylthio)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-6-fluoro-benzamide Formula: C19H18ClFN4O2S MolecularWeight: 420.888223

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=CC=C2OC)CNC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=CC=C2OC)CNC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H18ClFN4O2S/c1-3-28-19-24-23-16(25(19)14-9-4-5-10-15(14)27-2)11-22-18(26)17-12(20)7-6-8-13(17)21/h4-10H,3,11H2,1-2H3,(H,22,26)