Vitas-M small molecule compound

N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3-nitrobenzamide

Catalog ID
STK053699
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)Nc1ccc2c(c1)nc(o2)c1ccc(c(c1)Cl)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 C21H13Cl2N3O4 MW 442.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2N3O4/c1-11-2-3-12(9-18(11)26(28)29)20(27)24-14-5-7-19-17(10-14)25-21(30-19)13-4-6-15(22)16(23)8-13/h2-10H,1H3,(H,24,27)
InChIKey
JQOIVNJJBOHEMV-UHFFFAOYSA-N
Synonyms
331446-86-7
331446867
CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=C(C=C4)Cl)Cl)(N+)(=O)(O)
InChI=1SC21H13Cl2N3O4c1112312(918(11)26(28)29)20(27)2414571917(1014)2521(3019)134615(22)16(23)813h210H1H3(H2427)
MFCD00808787
N(2(34DICHLOROPHENYL)13BENZOXAZOL5YL)3NITRO4METHYLBENZAMIDE
N(2(34DICHLOROPHENYL)13BENZOXAZOL5YL)4METHYL3NITROBENZAMIDE
N(2(34DICHLOROPHENYL)BENZOOXAZOL5YL)4
N(2(34DICHLOROPHENYL)BENZOOXAZOL5YL)4METHYL3NITROBENZAMIDE
O=C(c1ccc(c(c1)(N+)(=O)(O))C)Nc1ccc2c(c1)nc(o2)c1ccc(c(c1)Cl)Cl
STK053699
ZINC000002055615
ZINC02055615
ZINC2055615

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Available files

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