Vitas-M small molecule compound
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2-methyl-2,3-dihydro-1-benzofuran-5-carboxamide
Catalog ID
STL430195
SMILES CC1Oc2c(C1)cc(cc2)C(=O)NCc1ccc2c(c1)OCCCO2
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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 C20H21NO4 MW 339.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4/c1-13-9-16-11-15(4-6-17(16)25-13)20(22)21-12-14-3-5-18-19(10-14)24-8-2-7-23-18/h3-6,10-11,13H,2,7-9,12H2,1H3,(H,21,22)InChIKey
IZOFMNIBWFCJLA-UHFFFAOYSA-NSynonyms
CC1CC2=C(O1)C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCCCO4
InChI=1SC20H21NO4c1139161115(4617(16)2513)20(22)211214351819(1014)248272318h36101113H27912H21H3(H2122)
MFCD27220872
N(34dihydro2H15benzodioxepin7ylmethyl)2methyl23dihydro1benzofuran5carboxamide
ZINC000064986964
ZINC000064986965
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