N1'-[2-[5-(dimethylaminomethyl)furan-2-yl]sulfanylethyl]-N1-methyl-2-nitro-ethene-1,1-diamine

Systemtic Name: N1'-[2-[5-(dimethylaminomethyl)furan-2-yl]sulfanylethyl]-N1-methyl-2-nitro-ethene-1,1-diamine Openeye Name: N1'-[2-[[5-(dimethylaminomethyl)-2-furyl]sulfanyl]ethyl]-N1-methyl-2-nitro-ethene-1,1-diamine CAS Name: N1'-[2-[[5-(dimethylaminomethyl)-2-furanyl]thio]ethyl]-N1-methyl-2-nitroethene-1,1-diamine IUPAC Name: 1-N'-[2-[5-(dimethylaminomethyl)furan-2-yl]sulfanylethyl]-1-N-methyl-2-nitroethene-1,1-diamine Traditional Name: dimethyl-[[5-[2-[[1-(methylamino)-2-nitro-vinyl]amino]ethylthio]-2-furyl]methyl]amine Formula: C12H20N4O3S MolecularWeight: 300.3772

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=C[N+](=O)[O-])NCCSC1=CC=C(O1)CN(C)C

Isomeric SMILES

CNC(=C[N+](=O)[O-])NCCSC1=CC=C(O1)CN(C)C

InChI

InChI=1S/C12H20N4O3S/c1-13-11(9-16(17)18)14-6-7-20-12-5-4-10(19-12)8-15(2)3/h4-5,9,13-14H,6-8H2,1-3H3