Vitas-M small molecule compound

2-iodo-N'-[(2E)-1-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ylidene]benzohydrazide

Catalog ID
STL170555
SMILES C/C(=N\NC(=O)c1ccccc1I)/Cn1cnc(n1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H11IN6O3 MW 414.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11IN6O3/c1-8(6-18-7-14-12(17-18)19(21)22)15-16-11(20)9-4-2-3-5-10(9)13/h2-5,7H,6H2,1H3,(H,16,20)/b15-8+
InChIKey
WOXQGVMVYKAYNX-OVCLIPMQSA-N
Synonyms

2iodoN((2E)1(3nitro1H124triazol1yl)propan2ylidene)benzohydrazide
2iodoN((E)1(3nitro124triazol1yl)propan2ylideneamino)benzamide
CC(=NNC(=O)C1=CC=CC=C1I)CN2C=NC(=N2)(N+)(=O)(O)
CC(=NNC(=O)c1ccccc1I)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC12H11IN6O3c18(61871412(1718)19(21)22)151611(20)9423510(9)13h257H6H21H3(H1620)b158+
MFCD01243488
N(2(3NITRO1H124TRIAZOL1YL)1METHYLETHYLIDENE)2IODOBENZOHYDRAZIDE
ZINC000008384956
ZINC33288588

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Available files

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