Vitas-M small molecule compound

1-chloro-4-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}phthalazine

Catalog ID
STK741233
SMILES C/C(=N\Nc1nnc(c2c1cccc2)Cl)/c1ccc(cc1)[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 C16H12ClN5O2 MW 341.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN5O2/c1-10(11-6-8-12(9-7-11)22(23)24)18-20-16-14-5-3-2-4-13(14)15(17)19-21-16/h2-9H,1H3,(H,20,21)/b18-10+
InChIKey
GKXRTVIPCADKKD-VCHYOVAHSA-N
Synonyms

(E)1chloro4(2(1(4nitrophenyl)ethylidene)hydrazinyl)phthalazine
1chloro4((2E)2(1(4nitrophenyl)ethylidene)hydrazinyl)phthalazine
4chloroN((E)1(4nitrophenyl)ethylideneamino)phthalazin1amine
CC(=NNC1=NN=C(C2=CC=CC=C21)Cl)C3=CC=C(C=C3)(N+)(=O)(O)
CC(=NNc1nnc(c2c1cccc2)Cl)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H12ClN5O2c110(116812(9711)22(23)24)18201614532413(14)15(17)192116h29H1H3(H2021)b1810+
MFCD02995958
ZINC000004812459
ZINC06780336
ZINC6780336

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.