2,4,5-trimethyl-5-phenyl-1,2,4-triazolidin-1-ium-3-thione

Systemtic Name: 2,4,5-trimethyl-5-phenyl-1,2,4-triazolidin-1-ium-3-thione Openeye Name: 2,4,5-trimethyl-5-phenyl-1,2,4-triazolidin-1-ium-3-thione CAS Name: 2,4,5-trimethyl-5-phenyl-1,2,4-triazolidin-1-ium-3-thione IUPAC Name: 2,4,5-trimethyl-5-phenyl-1,2,4-triazolidin-1-ium-3-thione Traditional Name: 2,4,5-trimethyl-5-phenyl-1,2,4-triazolidin-1-ium-3-thione Formula: C11H16N3S+ MolecularWeight: 222.32984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1([NH2+]N(C(=S)N1C)C)C2=CC=CC=C2

Isomeric SMILES

CC1([NH2+]N(C(=S)N1C)C)C2=CC=CC=C2

InChI

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