N',N'-diethyl-N-[1-[(5-nitrofuran-2-yl)methylideneamino]benzimidazol-2-yl]ethane-1,2-diamine

Systemtic Name: N',N'-diethyl-N-[1-[(5-nitrofuran-2-yl)methylideneamino]benzimidazol-2-yl]ethane-1,2-diamine Openeye Name: N',N'-diethyl-N-[1-[(5-nitro-2-furyl)methyleneamino]benzimidazol-2-yl]ethane-1,2-diamine CAS Name: N',N'-diethyl-N-[1-[(5-nitro-2-furanyl)methylideneamino]-2-benzimidazolyl]ethane-1,2-diamine IUPAC Name: N',N'-diethyl-N-[1-[(5-nitrofuran-2-yl)methylideneamino]benzimidazol-2-yl]ethane-1,2-diamine Traditional Name: diethyl-[2-[[1-[(5-nitro-2-furyl)methyleneamino]benzimidazol-2-yl]amino]ethyl]amine Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC2=CC=CC=C2N1N=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNC1=NC2=CC=CC=C2N1N=CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O3/c1-3-22(4-2)12-11-19-18-21-15-7-5-6-8-16(15)23(18)20-13-14-9-10-17(27-14)24(25)26/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,21)