Vitas-M small molecule compound

propyl 4-{[(2E)-3-(5-chloro-7-methoxy-1-benzofuran-2-yl)prop-2-enoyl]amino}benzoate

Catalog ID
STL120099
SMILES CCCOC(=O)c1ccc(cc1)NC(=O)/C=C/c1cc2c(o1)c(OC)cc(c2)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 C22H20ClNO5 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO5/c1-3-10-28-22(26)14-4-6-17(7-5-14)24-20(25)9-8-18-12-15-11-16(23)13-19(27-2)21(15)29-18/h4-9,11-13H,3,10H2,1-2H3,(H,24,25)/b9-8+
InChIKey
MBKOBMRDAXTMTJ-CMDGGOBGSA-N
Synonyms

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=CC(=CC(=C3O2)OC)Cl
CCCOC(=O)c1ccc(cc1)NC(=O)C=Cc1cc2c(o1)c(OC)cc(c2)Cl
InChI=1SC22H20ClNO5c13102822(26)144617(7514)2420(25)981812151116(23)1319(272)21(15)2918h491113H310H212H3(H2425)b98+
MFCD20753201
propyl4(((2E)3(5chloro7methoxy1benzofuran2yl)prop2enoyl)amino)benzoate
propyl4(((E)3(5chloro7methoxy1benzofuran2yl)prop2enoyl)amino)benzoate
ZINC000067339481
ZINC67339481

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Available files

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