N-[(E)-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-[(E)-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-[(E)-[5-(2-bromo-4-nitro-phenyl)-2-furyl]methyleneamino]-1H-1,2,4-triazole-5-carboxamide CAS Name: N-[(E)-[5-(2-bromo-4-nitrophenyl)-2-furanyl]methylideneamino]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-[(E)-[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-[(E)-[5-(2-bromo-4-nitro-phenyl)-2-furyl]methyleneamino]-1H-1,2,4-triazole-5-carboxamide Formula: C14H9BrN6O4 MolecularWeight: 405.16306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)C=NNC(=O)C3=NC=NN3

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)/C=N/NC(=O)C3=NC=NN3

InChI

InChI=1S/C14H9BrN6O4/c15-11-5-8(21(23)24)1-3-10(11)12-4-2-9(25-12)6-17-20-14(22)13-16-7-18-19-13/h1-7H,(H,20,22)(H,16,18,19)/b17-6+