N,N-dimethyl-N'-(3-methyl-5-nitro-imidazol-4-yl)-1-thiophen-2-yl-ethane-1,2-diamine

Systemtic Name: N,N-dimethyl-N'-(3-methyl-5-nitro-imidazol-4-yl)-1-thiophen-2-yl-ethane-1,2-diamine Openeye Name: N,N-dimethyl-N'-(3-methyl-5-nitro-imidazol-4-yl)-1-(2-thienyl)ethane-1,2-diamine CAS Name: N,N-dimethyl-N'-(3-methyl-5-nitro-4-imidazolyl)-1-thiophen-2-ylethane-1,2-diamine IUPAC Name: N,N-dimethyl-N'-(3-methyl-5-nitroimidazol-4-yl)-1-thiophen-2-ylethane-1,2-diamine Traditional Name: dimethyl-[2-[(3-methyl-5-nitro-imidazol-4-yl)amino]-1-(2-thienyl)ethyl]amine Formula: C12H17N5O2S MolecularWeight: 295.36068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCC(C2=CC=CS2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCC(C2=CC=CS2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H17N5O2S/c1-15(2)9(10-5-4-6-20-10)7-13-11-12(17(18)19)14-8-16(11)3/h4-6,8-9,13H,7H2,1-3H3