N6-(3-bromophenyl)-N5-[(E)-(4-nitrophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

Systemtic Name: N6-(3-bromophenyl)-N5-[(E)-(4-nitrophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine Openeye Name: N6-(3-bromophenyl)-N5-[(E)-(4-nitrophenyl)methyleneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine CAS Name: N6-(3-bromophenyl)-N5-[(E)-(4-nitrophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine IUPAC Name: 6-N-(3-bromophenyl)-5-N-[(E)-(4-nitrophenyl)methylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine Traditional Name: [6-(3-bromoanilino)furazano[3,4-b]pyrazin-5-yl]-[(E)-(4-nitrobenzylidene)amino]amine Formula: C17H11BrN8O3 MolecularWeight: 455.22504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC3=NON=C3N=C2NN=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC3=NON=C3N=C2N/N=C/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11BrN8O3/c18-11-2-1-3-12(8-11)20-14-15(22-17-16(21-14)24-29-25-17)23-19-9-10-4-6-13(7-5-10)26(27)28/h1-9H,(H,20,21,24)(H,22,23,25)/b19-9+