5-ethyl-2-phenyl-5-propan-2-yl-1,2,4-triazolidine-3-thione

Systemtic Name: 5-ethyl-2-phenyl-5-propan-2-yl-1,2,4-triazolidine-3-thione Openeye Name: 5-ethyl-5-isopropyl-2-phenyl-1,2,4-triazolidine-3-thione CAS Name: 5-ethyl-2-phenyl-5-propan-2-yl-1,2,4-triazolidine-3-thione IUPAC Name: 5-ethyl-2-phenyl-5-propan-2-yl-1,2,4-triazolidine-3-thione Traditional Name: 5-ethyl-5-isopropyl-2-phenyl-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=CC=C2)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3S/c1-4-13(10(2)3)14-12(17)16(15-13)11-8-6-5-7-9-11/h5-10,15H,4H2,1-3H3,(H,14,17)