N,N-diethyl-2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamine

Systemtic Name: N,N-diethyl-2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamine Openeye Name: N,N-diethyl-2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamine CAS Name: N,N-diethyl-2-[(4-nitro-1H-benzimidazol-2-yl)thio]ethanamine IUPAC Name: N,N-diethyl-2-[(4-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamine Traditional Name: diethyl-[2-[(4-nitro-1H-benzimidazol-2-yl)thio]ethyl]amine Formula: C13H18N4O2S MolecularWeight: 294.37262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC2=C(N1)C=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCSC1=NC2=C(N1)C=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O2S/c1-3-16(4-2)8-9-20-13-14-10-6-5-7-11(17(18)19)12(10)15-13/h5-7H,3-4,8-9H2,1-2H3,(H,14,15)