[3-(4-bromophenyl)-3-(dimethylcarbamothioylsulfanyl)-2-nitro-propyl] N,N-dimethylcarbamodithioate

Systemtic Name: [3-(4-bromophenyl)-3-(dimethylcarbamothioylsulfanyl)-2-nitro-propyl] N,N-dimethylcarbamodithioate Openeye Name: [3-(4-bromophenyl)-3-(dimethylcarbamothioylsulfanyl)-2-nitro-propyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [3-(4-bromophenyl)-3-[[dimethylamino(sulfanylidene)methyl]thio]-2-nitropropyl] ester IUPAC Name: [3-(4-bromophenyl)-3-(dimethylcarbamothioylsulfanyl)-2-nitropropyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [3-(4-bromophenyl)-3-(dimethylthiocarbamoylthio)-2-nitro-propyl] ester Formula: C15H20BrN3O2S4 MolecularWeight: 482.5022

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(C(C1=CC=C(C=C1)Br)SC(=S)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=S)SCC(C(C1=CC=C(C=C1)Br)SC(=S)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H20BrN3O2S4/c1-17(2)14(22)24-9-12(19(20)21)13(25-15(23)18(3)4)10-5-7-11(16)8-6-10/h5-8,12-13H,9H2,1-4H3