Vitas-M small molecule compound
N-[(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STL430204
SMILES COc1cc2OCCCOc2cc1CNC(=O)c1ccc2c(c1)OCCO2
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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 C20H21NO6 MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6/c1-23-16-11-19-18(24-5-2-6-25-19)10-14(16)12-21-20(22)13-3-4-15-17(9-13)27-8-7-26-15/h3-4,9-11H,2,5-8,12H2,1H3,(H,21,22)InChIKey
GTVWKWYFGXSETM-UHFFFAOYSA-NSynonyms
COC1=CC2=C(C=C1CNC(=O)C3=CC4=C(C=C3)OCCO4)OCCCO2
InChI=1SC20H21NO6c12316111918(245262519)1014(16)122120(22)13341517(913)27872615h34911H25812H21H3(H2122)
MFCD27220892
N((7methoxy34dihydro2H15benzodioxepin8yl)methyl)23dihydro14benzodioxine6carboxamide
N((8methoxy34dihydro2H15benzodioxepin7yl)methyl)23dihydro14benzodioxine6carboxamide
ZINC000064986981
ZINC64986981
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