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

Systemtic Name: 5-(2-bromophenyl)-3-(2-methylprop-2-enylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(2-bromophenyl)-3-(2-methylallylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(2-bromophenyl)-3-(2-methylprop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-(2-bromophenyl)-3-(2-methylprop-2-enylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(2-bromophenyl)-3-(2-methylallylthio)-1H-1,2,4-triazole Formula: C12H12BrN3S MolecularWeight: 310.21278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NNC(=N1)C2=CC=CC=C2Br

Isomeric SMILES

CC(=C)CSC1=NNC(=N1)C2=CC=CC=C2Br

InChI

InChI=1S/C12H12BrN3S/c1-8(2)7-17-12-14-11(15-16-12)9-5-3-4-6-10(9)13/h3-6H,1,7H2,2H3,(H,14,15,16)