5-butyl-5-ethyl-2-phenyl-1,2,4-triazolidine-3-thione

Systemtic Name: 5-butyl-5-ethyl-2-phenyl-1,2,4-triazolidine-3-thione Openeye Name: 5-butyl-5-ethyl-2-phenyl-1,2,4-triazolidine-3-thione CAS Name: 5-butyl-5-ethyl-2-phenyl-1,2,4-triazolidine-3-thione IUPAC Name: 5-butyl-5-ethyl-2-phenyl-1,2,4-triazolidine-3-thione Traditional Name: 5-butyl-5-ethyl-2-phenyl-1,2,4-triazolidine-3-thione Formula: C14H21N3S MolecularWeight: 263.40164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(NC(=S)N(N1)C2=CC=CC=C2)CC

Isomeric SMILES

CCCCC1(NC(=S)N(N1)C2=CC=CC=C2)CC

InChI

InChI=1S/C14H21N3S/c1-3-5-11-14(4-2)15-13(18)17(16-14)12-9-7-6-8-10-12/h6-10,16H,3-5,11H2,1-2H3,(H,15,18)