3-[3-(3-methylphenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[3-(3-methylphenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[3-(3-methylphenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[3-(3-methylphenoxy)propylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[3-(3-methylphenoxy)propylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[3-(3-methylphenoxy)propylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSC2=NNC(=N2)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSC2=NNC(=N2)N

InChI

InChI=1S/C12H16N4OS/c1-9-4-2-5-10(8-9)17-6-3-7-18-12-14-11(13)15-16-12/h2,4-5,8H,3,6-7H2,1H3,(H3,13,14,15,16)