Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chlorophenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK553030
SMILES O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/c1ccccc1Cl

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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 C18H12ClN9O4 MW 453.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12ClN9O4/c19-13-7-2-1-4-11(13)9-21-23-18(29)14-15(10-5-3-6-12(8-10)28(30)31)27(26-22-14)17-16(20)24-32-25-17/h1-9H,(H2,20,24)(H,23,29)/b21-9+
InChIKey
OEEBBEPDUXKGRV-ZVBGSRNCSA-N
Synonyms
836630-34-3
(E)1(4amino125oxadiazol3yl)N(2chlorobenzylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(2chlorophenyl)methylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(2CHLOROPHENYL)METHYLIDENEAMINO)5(3NITROPHENYL)TRIAZOLE4CARBOXAMIDE
836630343
C1=CC=C(C(=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC18H12ClN9O4c1913721411(13)9212318(29)1415(1053612(810)28(30)31)27(262214)1716(20)24322517h19H(H22024)(H2329)b219+
MFCD02155870
O=C(c1nnn(c1c1cccc(c1)(N+)(=O)(O))c1nonc1N)NN=Cc1ccccc1Cl
ZINC000002251043
ZINC33351601

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Available files

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