4-methyl-3-(phenoxymethyl)-5-propan-2-ylsulfanyl-1,2,4-triazole

Systemtic Name: 4-methyl-3-(phenoxymethyl)-5-propan-2-ylsulfanyl-1,2,4-triazole Openeye Name: 3-isopropylsulfanyl-4-methyl-5-(phenoxymethyl)-1,2,4-triazole CAS Name: 4-methyl-3-(phenoxymethyl)-5-(propan-2-ylthio)-1,2,4-triazole IUPAC Name: 4-methyl-3-(phenoxymethyl)-5-propan-2-ylsulfanyl-1,2,4-triazole Traditional Name: 3-(isopropylthio)-4-methyl-5-(phenoxymethyl)-1,2,4-triazole Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1C)COC2=CC=CC=C2

Isomeric SMILES

CC(C)SC1=NN=C(N1C)COC2=CC=CC=C2

InChI

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