3-[(3-methoxyphenyl)methylsulfanyl]-5-propan-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-[(3-methoxyphenyl)methylsulfanyl]-5-propan-2-yl-1H-1,2,4-triazole Openeye Name: 5-isopropyl-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 3-[(3-methoxyphenyl)methylthio]-5-propan-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[(3-methoxyphenyl)methylsulfanyl]-5-propan-2-yl-1H-1,2,4-triazole Traditional Name: 5-isopropyl-3-(m-anisylthio)-1H-1,2,4-triazole Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SCC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)C1=NC(=NN1)SCC2=CC(=CC=C2)OC

InChI

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