N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C20H27N7O3 MolecularWeight: 413.47348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2N1CCN(CC)CC)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2N1CCN(CC)CC)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N7O3/c1-4-17(26-14-15(13-21-26)27(29)30)19(28)23-20-22-16-9-7-8-10-18(16)25(20)12-11-24(5-2)6-3/h7-10,13-14,17H,4-6,11-12H2,1-3H3,(H,22,23,28)