Vitas-M small molecule compound
2-(4-tert-butylphenoxy)-N'-{(E)-[3-nitro-4-(pyrrolidin-1-yl)phenyl]methylidene}acetohydrazide
Catalog ID
STK755392
SMILES O=C(COc1ccc(cc1)C(C)(C)C)N/N=C/c1ccc(c(c1)[N+](=O)[O-])N1CCCC1
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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 C23H28N4O4 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O4/c1-23(2,3)18-7-9-19(10-8-18)31-16-22(28)25-24-15-17-6-11-20(21(14-17)27(29)30)26-12-4-5-13-26/h6-11,14-15H,4-5,12-13,16H2,1-3H3,(H,25,28)/b24-15+InChIKey
HHEBRPCPEMHSQA-BUVRLJJBSA-NSynonyms
2(4tertbutylphenoxy)N((E)(3nitro4(pyrrolidin1yl)phenyl)methylidene)acetohydrazide
2(4tertbutylphenoxy)N((E)(3nitro4pyrrolidin1ylphenyl)methylideneamino)acetamide
CC(C)(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CC(=C(C=C2)N3CCCC3)(N+)(=O)(O)
InChI=1SC23H28N4O4c123(23)187919(10818)311622(28)2524151761120(21(1417)27(29)30)2612451326h6111415H45121316H213H3(H2528)b2415+
MFCD00762629
O=C(COc1ccc(cc1)C(C)(C)C)NN=Cc1ccc(c(c1)(N+)(=O)(O))N1CCCC1
ZINC000004117156
ZINC33246675
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