Vitas-M small molecule compound

ethyl 5-(2-{2-[(3-methoxyphenyl)carbonyl]hydrazinyl}-2-oxoethoxy)-2-methyl-1-benzofuran-3-carboxylate

Catalog ID
STK541477
SMILES CCOC(=O)c1c(C)oc2c1cc(OCC(=O)NNC(=O)c1cccc(c1)OC)cc2

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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 C22H22N2O7 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7/c1-4-29-22(27)20-13(2)31-18-9-8-16(11-17(18)20)30-12-19(25)23-24-21(26)14-6-5-7-15(10-14)28-3/h5-11H,4,12H2,1-3H3,(H,23,25)(H,24,26)
InChIKey
FPBKXLPMTBQROS-UHFFFAOYSA-N
Synonyms
488724-20-5
488724205
CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NNC(=O)C3=CC(=CC=C3)OC)C
ETHYL5((N((3METHOXYPHENYL)CARBONYLAMINO)CARBAMOYL)METHOXY)2METHYLBENZO(B)FURAN3CARBOXYLATE
ETHYL5(2(2((3METHOXYPHENYL)CARBONYL)HYDRAZINO)2OXOETHOXY)2METHYL1BENZOFURAN3CARBOXYLATE
ethyl5(2(2((3methoxyphenyl)carbonyl)hydrazinyl)2oxoethoxy)2methyl1benzofuran3carboxylate
ETHYL5(2(2(3METHOXYBENZOYL)HYDRAZINYL)2OXOETHOXY)2METHYL1BENZOFURAN3CARBOXYLATE
ethyl5(2(2(3methoxybenzoyl)hydrazinyl)2oxoethoxy)2methylbenzofuran3carboxylate
InChI=1SC22H22N2O7c142922(27)2013(2)31189816(1117(18)20)301219(25)232421(26)1465715(1014)283h511H412H213H3(H2325)(H2426)
MFCD03291404
ZINC000009597101
ZINC09597101
ZINC9597101

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Available files

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