2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamine

Systemtic Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamine Openeye Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamine CAS Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]ethanamine IUPAC Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamine Traditional Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]ethylamine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SCCN

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SCCN

InChI

InChI=1S/C12H16N4S/c1-2-11-14-15-12(17-9-8-13)16(11)10-6-4-3-5-7-10/h3-7H,2,8-9,13H2,1H3