N',N'-dimethyl-N-[5-(1-methyl-5-nitro-imidazol-2-yl)-3H-1,2,3-thiadiazol-2-yl]propane-1,3-diamine

Systemtic Name: N',N'-dimethyl-N-[5-(1-methyl-5-nitro-imidazol-2-yl)-3H-1,2,3-thiadiazol-2-yl]propane-1,3-diamine Openeye Name: N',N'-dimethyl-N-[5-(1-methyl-5-nitro-imidazol-2-yl)-3H-thiadiazol-2-yl]propane-1,3-diamine CAS Name: N',N'-dimethyl-N-[5-(1-methyl-5-nitro-2-imidazolyl)-3H-thiadiazol-2-yl]propane-1,3-diamine IUPAC Name: N',N'-dimethyl-N-[5-(1-methyl-5-nitroimidazol-2-yl)-3H-thiadiazol-2-yl]propane-1,3-diamine Traditional Name: dimethyl-[3-[[5-(1-methyl-5-nitro-imidazol-2-yl)-3H-thiadiazol-2-yl]amino]propyl]amine Formula: C11H19N7O2S MolecularWeight: 313.37926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C2=CNN(S2)NCCCN(C)C)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C2=CNN(S2)NCCCN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C11H19N7O2S/c1-15(2)6-4-5-13-18-14-7-9(21-18)11-12-8-10(16(11)3)17(19)20/h7-8,13-14H,4-6H2,1-3H3