3-(2-methylprop-2-enylsulfanyl)-5-phenyl-1H-1,2,4-triazole

Systemtic Name: 3-(2-methylprop-2-enylsulfanyl)-5-phenyl-1H-1,2,4-triazole Openeye Name: 3-(2-methylallylsulfanyl)-5-phenyl-1H-1,2,4-triazole CAS Name: 3-(2-methylprop-2-enylthio)-5-phenyl-1H-1,2,4-triazole IUPAC Name: 3-(2-methylprop-2-enylsulfanyl)-5-phenyl-1H-1,2,4-triazole Traditional Name: 3-(2-methylallylthio)-5-phenyl-1H-1,2,4-triazole Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(=C)CSC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3S/c1-9(2)8-16-12-13-11(14-15-12)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3,(H,13,14,15)