5-(5-chloranyl-2-methoxy-phenyl)-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-(3-methylbut-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-(3-methylbut-2-enylthio)-1H-1,2,4-triazole Formula: C14H16ClN3OS MolecularWeight: 309.81434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NNC(=N1)C2=C(C=CC(=C2)Cl)OC)C

Isomeric SMILES

CC(=CCSC1=NNC(=N1)C2=C(C=CC(=C2)Cl)OC)C

InChI

InChI=1S/C14H16ClN3OS/c1-9(2)6-7-20-14-16-13(17-18-14)11-8-10(15)4-5-12(11)19-3/h4-6,8H,7H2,1-3H3,(H,16,17,18)