4-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazole

Systemtic Name: 4-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazole Openeye Name: 4-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazole CAS Name: 4-methyl-3-(methylthio)-5-phenyl-1,2,4-triazole IUPAC Name: 4-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazole Traditional Name: 4-methyl-3-(methylthio)-5-phenyl-1,2,4-triazole Formula: C10H11N3S MolecularWeight: 205.27944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2=CC=CC=C2

Isomeric SMILES

CN1C(=NN=C1SC)C2=CC=CC=C2

InChI

InChI=1S/C10H11N3S/c1-13-9(11-12-10(13)14-2)8-6-4-3-5-7-8/h3-7H,1-2H3