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

Systemtic Name: [3-(dimethylcarbamothioylsulfanyl)-2-nitro-3-phenyl-propyl] N,N-dimethylcarbamodithioate Openeye Name: [3-(dimethylcarbamothioylsulfanyl)-2-nitro-3-phenyl-propyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [3-[[dimethylamino(sulfanylidene)methyl]thio]-2-nitro-3-phenylpropyl] ester IUPAC Name: [3-(dimethylcarbamothioylsulfanyl)-2-nitro-3-phenylpropyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [3-(dimethylthiocarbamoylthio)-2-nitro-3-phenyl-propyl] ester Formula: C15H21N3O2S4 MolecularWeight: 403.60614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O2S4/c1-16(2)14(21)23-10-12(18(19)20)13(24-15(22)17(3)4)11-8-6-5-7-9-11/h5-9,12-13H,10H2,1-4H3