2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]phenyl]ethanamine

Systemtic Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]phenyl]ethanamine Openeye Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]phenyl]ethanamine CAS Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethoxy]phenyl]ethanamine IUPAC Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]phenyl]ethanamine Traditional Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethoxy]phenyl]ethylamine Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCOC2=CC=C(C=C2)CCN

Isomeric SMILES

CN1C=NN=C1SCCOC2=CC=C(C=C2)CCN

InChI

InChI=1S/C13H18N4OS/c1-17-10-15-16-13(17)19-9-8-18-12-4-2-11(3-5-12)6-7-14/h2-5,10H,6-9,14H2,1H3