Vitas-M small molecule compound

2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-{(E)-[2-chloro-4-(dimethylamino)-5-nitrophenyl]methylidene}acetohydrazide

Catalog ID
STK754477
SMILES O=C(Cn1c(nc2c1cccc2)c1nonc1N)N/N=C/c1cc([N+](=O)[O-])c(cc1Cl)N(C)C

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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 C20H18ClN9O4 MW 483.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN9O4/c1-28(2)15-8-12(21)11(7-16(15)30(32)33)9-23-25-17(31)10-29-14-6-4-3-5-13(14)24-20(29)18-19(22)27-34-26-18/h3-9H,10H2,1-2H3,(H2,22,27)(H,25,31)/b23-9+
InChIKey
WKHCTLNTGSVQKI-NUGSKGIGSA-N
Synonyms

2(2(4amino125oxadiazol3yl)1Hbenzimidazol1yl)N((E)(2chloro4(dimethylamino)5nitrophenyl)methylidene)acetohydrazide
2(2(4amino125oxadiazol3yl)benzimidazol1yl)N((E)(2chloro4(dimethylamino)5nitrophenyl)methylideneamino)acetamide
CN(C)C1=C(C=C(C(=C1)Cl)C=NNC(=O)CN2C3=CC=CC=C3N=C2C4=NON=C4N)(N+)(=O)(O)
InChI=1SC20H18ClN9O4c128(2)15812(21)11(716(15)30(32)33)9232517(31)102914643513(14)2420(29)1819(22)27342618h39H10H212H3(H22227)(H2531)b239+
MFCD00825964
O=C(Cn1c(nc2c1cccc2)c1nonc1N)NN=Cc1cc((N+)(=O)(O))c(cc1Cl)N(C)C
ZINC000008439197
ZINC102873468

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Available files

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