N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-1-[(5-fluoro-2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1-[(5-fluoro-2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C24H26FN7O4 MolecularWeight: 495.506143

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NN(C=C3)COC4=C(C=CC(=C4)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=NN(C=C3)COC4=C(C=CC(=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C24H26FN7O4/c1-3-29(4-2)13-14-31-20-8-6-5-7-18(20)26-24(31)27-23(33)19-11-12-30(28-19)16-36-22-15-17(25)9-10-21(22)32(34)35/h5-12,15H,3-4,13-14,16H2,1-2H3,(H,26,27,33)