3-butylsulfanyl-4-methyl-5-(4-methylphenyl)-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-4-methyl-5-(4-methylphenyl)-1,2,4-triazole Openeye Name: 3-butylsulfanyl-4-methyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-(butylthio)-4-methyl-5-(4-methylphenyl)-1,2,4-triazole IUPAC Name: 3-butylsulfanyl-4-methyl-5-(4-methylphenyl)-1,2,4-triazole Traditional Name: 3-(butylthio)-4-methyl-5-(p-tolyl)-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCSC1=NN=C(N1C)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H19N3S/c1-4-5-10-18-14-16-15-13(17(14)3)12-8-6-11(2)7-9-12/h6-9H,4-5,10H2,1-3H3