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

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-3-propan-2-ylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-isopropylsulfanyl-5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole CAS Name: 5-[(4-methoxyphenyl)methyl]-3-(propan-2-ylthio)-1H-1,2,4-triazole IUPAC Name: 5-[(4-methoxyphenyl)methyl]-3-propan-2-ylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(isopropylthio)-5-p-anisyl-1H-1,2,4-triazole Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NNC(=N1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)SC1=NNC(=N1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C13H17N3OS/c1-9(2)18-13-14-12(15-16-13)8-10-4-6-11(17-3)7-5-10/h4-7,9H,8H2,1-3H3,(H,14,15,16)