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

Systemtic Name: N-[4-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]-2-fluoro-benzamide CAS Name: N-[4-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]-2-fluorobenzamide Traditional Name: N-[4-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]-2-fluoro-benzamide Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCSC1=NN=C(N1C)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H17FN4OS/c1-3-25-18-22-21-16(23(18)2)12-8-10-13(11-9-12)20-17(24)14-6-4-5-7-15(14)19/h4-11H,3H2,1-2H3,(H,20,24)