N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide

Systemtic Name: N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide Openeye Name: N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide CAS Name: N-[[5-(ethylthio)-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide IUPAC Name: N-[[5-ethylsulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide Traditional Name: N-[[5-(ethylthio)-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide Formula: C19H19FN4OS MolecularWeight: 370.443763

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)F)CNC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)F)CNC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C19H19FN4OS/c1-3-26-19-23-22-17(24(19)16-9-7-15(20)8-10-16)12-21-18(25)14-6-4-5-13(2)11-14/h4-11H,3,12H2,1-2H3,(H,21,25)