3-methyl-5-[(2-methylphenyl)methylsulfanyl]-4-propyl-1,2,4-triazole

Systemtic Name: 3-methyl-5-[(2-methylphenyl)methylsulfanyl]-4-propyl-1,2,4-triazole Openeye Name: 3-methyl-5-(o-tolylmethylsulfanyl)-4-propyl-1,2,4-triazole CAS Name: 3-methyl-5-[(2-methylphenyl)methylthio]-4-propyl-1,2,4-triazole IUPAC Name: 3-methyl-5-[(2-methylphenyl)methylsulfanyl]-4-propyl-1,2,4-triazole Traditional Name: 3-methyl-5-[(2-methylbenzyl)thio]-4-propyl-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC2=CC=CC=C2C)C

Isomeric SMILES

CCCN1C(=NN=C1SCC2=CC=CC=C2C)C

InChI

InChI=1S/C14H19N3S/c1-4-9-17-12(3)15-16-14(17)18-10-13-8-6-5-7-11(13)2/h5-8H,4,9-10H2,1-3H3