Vitas-M small molecule compound

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

Catalog ID
STK005703
SMILES Fc1ccc(cc1)c1nc2c(o1)ccc(c2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])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 C21H14FN3O4 MW 391.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14FN3O4/c1-12-2-3-14(10-18(12)25(27)28)20(26)23-16-8-9-19-17(11-16)24-21(29-19)13-4-6-15(22)7-5-13/h2-11H,1H3,(H,23,26)
InChIKey
RYXYNQOHINUSSV-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)F)(N+)(=O)(O)
Fc1ccc(cc1)c1nc2c(o1)ccc(c2)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC21H14FN3O4c1122314(1018(12)25(27)28)20(26)2316891917(1116)2421(2919)134615(22)7513h211H1H3(H2326)
MFCD00753730
N(2(4FLUOROPHENYL)13BENZOXAZOL5YL)3NITRO4METHYLBENZAMIDE
N(2(4FLUOROPHENYL)13BENZOXAZOL5YL)4METHYL3NITROBENZAMIDE
N(2(4FLUOROPHENYL)BENZOOXAZOL5YL)4METHYL3NITROBENZAMIDE
N(2(4FLUOROPHENYL)BENZOXAZOL5YL)(4METHYL3NITROPHENYL)CARBOXAMIDE
STK005703
ZINC000000677439
ZINC00677439
ZINC677439

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.