4-methyl-3-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-methyl-3-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazole Openeye Name: 4-methyl-3-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazole CAS Name: 4-methyl-3-[3-(3-methylphenoxy)propylthio]-1,2,4-triazole IUPAC Name: 4-methyl-3-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazole Traditional Name: 4-methyl-3-[3-(3-methylphenoxy)propylthio]-1,2,4-triazole Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSC2=NN=CN2C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSC2=NN=CN2C

InChI

InChI=1S/C13H17N3OS/c1-11-5-3-6-12(9-11)17-7-4-8-18-13-15-14-10-16(13)2/h3,5-6,9-10H,4,7-8H2,1-2H3