3-[2-(5-bromanyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-6-(phenylmethyl)-1,2,4-triazin-5-olate

Systemtic Name: 3-[2-(5-bromanyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-6-(phenylmethyl)-1,2,4-triazin-5-olate Openeye Name: 6-benzyl-3-[2-(5-bromo-2-oxo-indol-3-yl)hydrazino]-1,2,4-triazin-5-olate CAS Name: 3-[(5-bromo-2-oxo-3-indolyl)hydrazo]-6-(phenylmethyl)-1,2,4-triazin-5-olate IUPAC Name: 6-benzyl-3-[2-(5-bromo-2-oxoindol-3-yl)hydrazinyl]-1,2,4-triazin-5-olate Traditional Name: 6-benzyl-3-[N'-(5-bromo-2-keto-indol-3-yl)hydrazino]-1,2,4-triazin-5-olate Formula: C18H12BrN6O2- MolecularWeight: 424.23088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=C(N=N2)NNC3=C4C=C(C=CC4=NC3=O)Br)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=C(N=N2)NNC3=C4C=C(C=CC4=NC3=O)Br)[O-]

InChI

InChI=1S/C18H13BrN6O2/c19-11-6-7-13-12(9-11)15(17(27)20-13)23-25-18-21-16(26)14(22-24-18)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,20,23,27)(H2,21,24,25,26)/p-1