N-butyl-N-[3-[2-(1-methyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]propyl]butan-1-amine

Systemtic Name: N-butyl-N-[3-[2-(1-methyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]propyl]butan-1-amine Openeye Name: N-butyl-N-[3-[2-(1-methyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]propyl]butan-1-amine CAS Name: N-butyl-N-[3-[2-(1-methyl-5-nitro-2-imidazolyl)-1-benzimidazolyl]propyl]-1-butanamine IUPAC Name: N-butyl-N-[3-[2-(1-methyl-5-nitroimidazol-2-yl)benzimidazol-1-yl]propyl]butan-1-amine Traditional Name: dibutyl-[3-[2-(1-methyl-5-nitro-imidazol-2-yl)benzimidazol-1-yl]propyl]amine Formula: C22H32N6O2 MolecularWeight: 412.52848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCN1C2=CC=CC=C2N=C1C3=NC=C(N3C)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)CCCN1C2=CC=CC=C2N=C1C3=NC=C(N3C)[N+](=O)[O-]

InChI

InChI=1S/C22H32N6O2/c1-4-6-13-26(14-7-5-2)15-10-16-27-19-12-9-8-11-18(19)24-22(27)21-23-17-20(25(21)3)28(29)30/h8-9,11-12,17H,4-7,10,13-16H2,1-3H3