Vitas-M small molecule compound

dimethyl {5-[(2-chlorobenzyl)amino]-2-[(E)-2-phenylethenyl]-1,3-oxazol-4-yl}phosphonate

Catalog ID
STK516898
SMILES COP(=O)(c1nc(oc1NCc1ccccc1Cl)/C=C/c1ccccc1)OC

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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 C20H20ClN2O4P MW 418.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN2O4P/c1-25-28(24,26-2)20-19(22-14-16-10-6-7-11-17(16)21)27-18(23-20)13-12-15-8-4-3-5-9-15/h3-13,22H,14H2,1-2H3/b13-12+
InChIKey
CWRQTYBMLREDQD-OUKQBFOZSA-N
Synonyms

COP(=O)(C1=C(OC(=N1)C=CC2=CC=CC=C2)NCC3=CC=CC=C3Cl)OC
COP(=O)(c1nc(oc1NCc1ccccc1Cl)C=Cc1ccccc1)OC
dimethyl(5((2chlorobenzyl)amino)2((E)2phenylethenyl)13oxazol4yl)phosphonate
InChI=1SC20H20ClN2O4Pc12528(24262)2019(22141610671117(16)21)2718(2320)1312158435915h31322H14H212H3b1312+
MFCD08548840
N((2chlorophenyl)methyl)4dimethoxyphosphoryl2((E)2phenylethenyl)13oxazol5amine
ZINC000012062708
ZINC12062708

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Available files

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