Vitas-M small molecule compound

2-[(4-butyl-6-chloro-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide

Catalog ID
STK578457
SMILES CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCc1ccncc1

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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 C21H21ClN2O4 MW 400.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O4/c1-2-3-4-15-9-21(26)28-18-11-19(17(22)10-16(15)18)27-13-20(25)24-12-14-5-7-23-8-6-14/h5-11H,2-4,12-13H2,1H3,(H,24,25)
InChIKey
CWXIDBHTYHQDKG-UHFFFAOYSA-N
Synonyms
900256-93-1
2((4butyl6chloro2oxo2Hchromen7yl)oxy)N(pyridin4ylmethyl)acetamide
2(4BUTYL6CHLORO2OXOCHROMEN7YL)OXYN(PYRIDIN4YLMETHYL)ACETAMIDE
900256931
CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3=CC=NC=C3
InChI=1SC21H21ClN2O4c123415921(26)28181119(17(22)1016(15)18)271320(25)24121457238614h511H241213H21H3(H2425)
MFCD06774429
ZINC000005245643
ZINC05245643
ZINC5245643

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Available files

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