Vitas-M small molecule compound
N-(11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl)-9-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL539851
SMILES COc1cc(cc2c1OCCCO2)C(=O)Nc1ccc2c(c1)C(=O)N1CCCC1C(=N2)O
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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 C23H23N3O6 MW 437.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O6/c1-30-18-10-13(11-19-20(18)32-9-3-8-31-19)21(27)24-14-5-6-16-15(12-14)23(29)26-7-2-4-17(26)22(28)25-16/h5-6,10-12,17H,2-4,7-9H2,1H3,(H,24,27)(H,25,28)InChIKey
DVRYPIWFXPKVOI-UHFFFAOYSA-NSynonyms
1435901-36-2~(N)(611dioxo6~(a)789tetrahydro5~(H)pyrrolo(21c)(14)benzodiazepin2yl)6methoxy34dihydro2~(H)15benzodioxepine8carboxamide
1435901362
71754849
InChI=1SC23H23N3O6c130181013(111920(18)329383119)21(27)2414561615(1214)23(29)2672417(26)22(28)2516h56101217H2479H21H3(H2427)(H2528)
MFCD31754949
N(11hydroxy5oxo23511atetrahydro1Hpyrrolo(21c)(14)benzodiazepin7yl)9methoxy34dihydro2H15benzodioxepine7carboxamide
ZINC000085877169
ZINC000085877176
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