(5R)-2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione

Systemtic Name: (5R)-2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione Openeye Name: (5R)-2-(4-chlorophenyl)-5-isobutyl-5-methyl-1,2,4-triazolidine-3-thione CAS Name: (5R)-2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione IUPAC Name: (5R)-2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione Traditional Name: (5R)-2-(4-chlorophenyl)-5-isobutyl-5-methyl-1,2,4-triazolidine-3-thione Formula: C13H18ClN3S MolecularWeight: 283.82012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(NC(=S)N(N1)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC(C)C[C@@]1(NC(=S)N(N1)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C13H18ClN3S/c1-9(2)8-13(3)15-12(18)17(16-13)11-6-4-10(14)5-7-11/h4-7,9,16H,8H2,1-3H3,(H,15,18)/t13-/m1/s1