5,5-diethyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione

Systemtic Name: 5,5-diethyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione Openeye Name: 5,5-diethyl-2-(p-tolyl)-1,2,4-triazolidine-3-thione CAS Name: 5,5-diethyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione IUPAC Name: 5,5-diethyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione Traditional Name: 5,5-diethyl-2-(p-tolyl)-1,2,4-triazolidine-3-thione Formula: C13H19N3S MolecularWeight: 249.37506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(NC(=S)N(N1)C2=CC=C(C=C2)C)CC

Isomeric SMILES

CCC1(NC(=S)N(N1)C2=CC=C(C=C2)C)CC

InChI

InChI=1S/C13H19N3S/c1-4-13(5-2)14-12(17)16(15-13)11-8-6-10(3)7-9-11/h6-9,15H,4-5H2,1-3H3,(H,14,17)