Vitas-M small molecule compound

N-[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-3-fluorobenzamide

Catalog ID
STK184477
SMILES COc1ccc(cc1Cl)c1oc2c(n1)cc(cc2)NC(=O)c1cccc(c1)F

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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 C21H14ClFN2O3 MW 396.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClFN2O3/c1-27-18-7-5-13(10-16(18)22)21-25-17-11-15(6-8-19(17)28-21)24-20(26)12-3-2-4-14(23)9-12/h2-11H,1H3,(H,24,26)
InChIKey
IIRIUKNAVBRNCQ-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=CC=C4)F)Cl
InChI=1SC21H14ClFN2O3c127187513(1016(18)22)2125171115(6819(17)2821)2420(26)1232414(23)912h211H1H3(H2426)
MFCD02803720
N(2(3CHLORO4METHOXYPHENYL)13BENZOXAZOL5YL)3FLUOROBENZAMIDE
ZINC000001172929
ZINC01172929
ZINC1172929

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Available files

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