5-cyclopropyl-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-cyclopropyl-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-cyclopropyl-3-(o-tolylmethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-cyclopropyl-3-[(2-methylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-cyclopropyl-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-cyclopropyl-3-[(2-methylbenzyl)thio]-1H-1,2,4-triazole Formula: C13H15N3S MolecularWeight: 245.3433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NNC(=N2)C3CC3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NNC(=N2)C3CC3

InChI

InChI=1S/C13H15N3S/c1-9-4-2-3-5-11(9)8-17-13-14-12(15-16-13)10-6-7-10/h2-5,10H,6-8H2,1H3,(H,14,15,16)