5-(4-methylphenyl)-3-propylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(4-methylphenyl)-3-propylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-propylsulfanyl-5-(p-tolyl)-1H-1,2,4-triazole CAS Name: 5-(4-methylphenyl)-3-(propylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-methylphenyl)-3-propylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(propylthio)-5-(p-tolyl)-1H-1,2,4-triazole Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NNC(=N1)C2=CC=C(C=C2)C

Isomeric SMILES

CCCSC1=NNC(=N1)C2=CC=C(C=C2)C

InChI

InChI=1S/C12H15N3S/c1-3-8-16-12-13-11(14-15-12)10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3,(H,13,14,15)