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

Systemtic Name: N-[(1S)-1-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]-4-fluoro-benzamide CAS Name: N-[(1S)-1-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-fluorobenzamide IUPAC Name: N-[(1S)-1-(5-ethylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-[5-(ethylthio)-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-fluoro-benzamide Formula: C14H17FN4OS MolecularWeight: 308.374383

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C)C(C)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCSC1=NN=C(N1C)[C@H](C)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H17FN4OS/c1-4-21-14-18-17-12(19(14)3)9(2)16-13(20)10-5-7-11(15)8-6-10/h5-9H,4H2,1-3H3,(H,16,20)/t9-/m0/s1