5-ethyl-5-methyl-2-phenyl-1,4-dihydro-1,2,4-triazol-2-ium-3-thiol

Systemtic Name: 5-ethyl-5-methyl-2-phenyl-1,4-dihydro-1,2,4-triazol-2-ium-3-thiol Openeye Name: 5-ethyl-5-methyl-2-phenyl-1,4-dihydro-1,2,4-triazol-2-ium-3-thiol CAS Name: 5-ethyl-5-methyl-2-phenyl-1,4-dihydro-1,2,4-triazol-2-ium-3-thiol IUPAC Name: 5-ethyl-5-methyl-2-phenyl-1,4-dihydro-1,2,4-triazol-2-ium-3-thiol Traditional Name: 5-ethyl-5-methyl-2-phenyl-1,4-dihydro-1,2,4-triazol-2-ium-3-thiol Formula: C11H16N3S+ MolecularWeight: 222.32984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(NC(=[N+](N1)C2=CC=CC=C2)S)C

Isomeric SMILES

CCC1(NC(=[N+](N1)C2=CC=CC=C2)S)C

InChI

InChI=1S/C11H15N3S/c1-3-11(2)12-10(15)14(13-11)9-7-5-4-6-8-9/h4-8,13H,3H2,1-2H3,(H,12,15)/p+1