[1-acetamido-2,2,2-tris(chloranyl)ethyl] N-butan-2-yl-N-(2-methylpropyl)carbamodithioate

Systemtic Name: [1-acetamido-2,2,2-tris(chloranyl)ethyl] N-butan-2-yl-N-(2-methylpropyl)carbamodithioate Openeye Name: (1-acetamido-2,2,2-trichloro-ethyl) N-isobutyl-N-sec-butyl-carbamodithioate CAS Name: N-butan-2-yl-N-(2-methylpropyl)carbamodithioic acid (1-acetamido-2,2,2-trichloroethyl) ester IUPAC Name: (1-acetamido-2,2,2-trichloroethyl) N-butan-2-yl-N-(2-methylpropyl)carbamodithioate Traditional Name: N-isobutyl-N-sec-butyl-carbamodithioic acid (1-acetamido-2,2,2-trichloro-ethyl) ester Formula: C13H23Cl3N2OS2 MolecularWeight: 393.82352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(C)C)C(=S)SC(C(Cl)(Cl)Cl)NC(=O)C

Isomeric SMILES

CCC(C)N(CC(C)C)C(=S)SC(C(Cl)(Cl)Cl)NC(=O)C

InChI

InChI=1S/C13H23Cl3N2OS2/c1-6-9(4)18(7-8(2)3)12(20)21-11(13(14,15)16)17-10(5)19/h8-9,11H,6-7H2,1-5H3,(H,17,19)