5-(4-methoxyphenyl)-3-propan-2-ylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(4-methoxyphenyl)-3-propan-2-ylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-isopropylsulfanyl-5-(4-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 5-(4-methoxyphenyl)-3-(propan-2-ylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-methoxyphenyl)-3-propan-2-ylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(isopropylthio)-5-(4-methoxyphenyl)-1H-1,2,4-triazole Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NNC(=N1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)SC1=NNC(=N1)C2=CC=C(C=C2)OC

InChI

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