1-[4-chloranyl-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]ethanol

Systemtic Name: 1-[4-chloranyl-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]ethanol Openeye Name: 1-[4-chloro-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]ethanol CAS Name: 1-[4-chloro-2-[[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]ethanol IUPAC Name: 1-[4-chloro-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]ethanol Traditional Name: 1-[4-chloro-2-[[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]ethanol Formula: C13H16ClN3OS MolecularWeight: 297.80364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC2=C(C=CC(=C2)Cl)C(C)O

Isomeric SMILES

CCC1=NC(=NN1)SCC2=C(C=CC(=C2)Cl)C(C)O

InChI

InChI=1S/C13H16ClN3OS/c1-3-12-15-13(17-16-12)19-7-9-6-10(14)4-5-11(9)8(2)18/h4-6,8,18H,3,7H2,1-2H3,(H,15,16,17)