Vitas-M small molecule compound
N-{1-[(2E)-2-(5-chloro-2-methoxybenzylidene)hydrazinyl]-3-methyl-1-oxobutan-2-yl}-3-nitrobenzamide (non-preferred name)
Catalog ID
STK122876
SMILES COc1ccc(cc1/C=N/NC(=O)C(C(C)C)NC(=O)c1cccc(c1)[N+](=O)[O-])Cl
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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 C20H21ClN4O5 MW 432.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4O5/c1-12(2)18(23-19(26)13-5-4-6-16(10-13)25(28)29)20(27)24-22-11-14-9-15(21)7-8-17(14)30-3/h4-12,18H,1-3H3,(H,23,26)(H,24,27)/b22-11+InChIKey
XIURLZOEYHIKQW-SSDVNMTOSA-NSynonyms
CC(C)C(C(=O)NN=CC1=C(C=CC(=C1)Cl)OC)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
COc1ccc(cc1C=NNC(=O)C(C(C)C)NC(=O)c1cccc(c1)(N+)(=O)(O))Cl
InChI=1SC20H21ClN4O5c112(2)18(2319(26)1354616(1013)25(28)29)20(27)24221114915(21)7817(14)303h41218H13H3(H2326)(H2427)b2211+
MFCD03563395
N((1E)2(5CHLORO2METHOXYPHENYL)1AZAVINYL)3METHYL2((3NITROPHENYL)CARBONYLAMINO)BUTANAMIDE
N(1((2E)2((5chloro2methoxyphenyl)methylidene)hydrazinyl)3methyl1oxobutan2yl)3nitrobenzamide
N(1((2E)2(5CHLORO2METHOXYBENZYLIDENE)HYDRAZINYL)3METHYL1OXOBUTAN2YL)3NITROBENZAMIDE(NONPREFERREDNAME)
ZINC000009305425
ZINC000009305429
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