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

Systemtic Name: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-methyl-3-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-methyl-3-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-methyl-3-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C11H13N3S MolecularWeight: 219.30602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=CN2C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=CN2C

InChI

InChI=1S/C11H13N3S/c1-9-3-5-10(6-4-9)7-15-11-13-12-8-14(11)2/h3-6,8H,7H2,1-2H3