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

Systemtic Name: 2-chloranyl-6-fluoranyl-N-[(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 2-chloro-6-fluoro-N-[(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 2-chloro-6-fluoro-N-[[4-phenyl-5-(propylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-chloro-6-fluoro-N-[(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 2-chloro-6-fluoro-N-[[4-phenyl-5-(propylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C19H18ClFN4OS MolecularWeight: 404.888823

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H18ClFN4OS/c1-2-11-27-19-24-23-16(25(19)13-7-4-3-5-8-13)12-22-18(26)17-14(20)9-6-10-15(17)21/h3-10H,2,11-12H2,1H3,(H,22,26)