Vitas-M small molecule compound
N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL504900
SMILES COc1cc2OCCCOc2cc1C(=O)Nc1sc2c(c1C(=O)N)CCCC2
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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 C20H22N2O5S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5S/c1-25-13-10-15-14(26-7-4-8-27-15)9-12(13)19(24)22-20-17(18(21)23)11-5-2-3-6-16(11)28-20/h9-10H,2-8H2,1H3,(H2,21,23)(H,22,24)InChIKey
RRFQKUITBVWYHQ-UHFFFAOYSA-NSynonyms
~(N)(3carbamoyl4567tetrahydro1benzothiophen2yl)7methoxy34dihydro2~(H)15benzodioxepine8carboxamide
22587246
InChI=1SC20H22N2O5Sc12513101514(267482715)912(13)19(24)222017(18(21)23)11523616(11)2820h910H28H21H3(H22123)(H2224)
MFCD15078985
N(3carbamoyl4567tetrahydro1benzothiophen2yl)8methoxy34dihydro2H15benzodioxepine7carboxamide
ZINC000015826401
ZINC15826401
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