3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole

Systemtic Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole Openeye Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole CAS Name: 3-[(2-methoxy-5-methylphenyl)methylthio]-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-[(2-methoxy-5-methylphenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole Traditional Name: 3-[(2-methoxy-5-methyl-benzyl)thio]-5-methyl-1H-1,2,4-triazole Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NNC(=N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NNC(=N2)C

InChI

InChI=1S/C12H15N3OS/c1-8-4-5-11(16-3)10(6-8)7-17-12-13-9(2)14-15-12/h4-6H,7H2,1-3H3,(H,13,14,15)