[2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]phenyl]methanamine

Systemtic Name: [2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]phenyl]methanamine Openeye Name: [2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]phenyl]methanamine CAS Name: [2-[2-(1H-1,2,4-triazol-5-ylthio)ethoxy]phenyl]methanamine IUPAC Name: [2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethoxy]phenyl]methanamine Traditional Name: [2-[2-(1H-1,2,4-triazol-5-ylthio)ethoxy]benzyl]amine Formula: C11H14N4OS MolecularWeight: 250.32006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN)OCCSC2=NC=NN2

Isomeric SMILES

C1=CC=C(C(=C1)CN)OCCSC2=NC=NN2

InChI

InChI=1S/C11H14N4OS/c12-7-9-3-1-2-4-10(9)16-5-6-17-11-13-8-14-15-11/h1-4,8H,5-7,12H2,(H,13,14,15)