[3-[2-methyl-5-nitro-6-(trichloromethyl)pyridin-3-yl]-3-oxidanylidene-propyl] N,N-dimethylcarbamodithioate

Systemtic Name: [3-[2-methyl-5-nitro-6-(trichloromethyl)pyridin-3-yl]-3-oxidanylidene-propyl] N,N-dimethylcarbamodithioate Openeye Name: [3-[2-methyl-5-nitro-6-(trichloromethyl)-3-pyridyl]-3-oxo-propyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [3-[2-methyl-5-nitro-6-(trichloromethyl)-3-pyridinyl]-3-oxopropyl] ester IUPAC Name: [3-[2-methyl-5-nitro-6-(trichloromethyl)pyridin-3-yl]-3-oxopropyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [3-keto-3-[2-methyl-5-nitro-6-(trichloromethyl)-3-pyridyl]propyl] ester Formula: C13H14Cl3N3O3S2 MolecularWeight: 430.75756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1C(=O)CCSC(=S)N(C)C)[N+](=O)[O-])C(Cl)(Cl)Cl

Isomeric SMILES

CC1=NC(=C(C=C1C(=O)CCSC(=S)N(C)C)[N+](=O)[O-])C(Cl)(Cl)Cl

InChI

InChI=1S/C13H14Cl3N3O3S2/c1-7-8(10(20)4-5-24-12(23)18(2)3)6-9(19(21)22)11(17-7)13(14,15)16/h6H,4-5H2,1-3H3