5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1H-1,2,4-triazole CAS Name: 5-(3,4-dimethoxyphenyl)-3-(methylthio)-1H-1,2,4-triazole IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-(3,4-dimethoxyphenyl)-3-(methylthio)-1H-1,2,4-triazole Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NN2)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NN2)SC)OC

InChI

InChI=1S/C11H13N3O2S/c1-15-8-5-4-7(6-9(8)16-2)10-12-11(17-3)14-13-10/h4-6H,1-3H3,(H,12,13,14)