Vitas-M small molecule compound
(1S,5R)-3-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]carbonyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL546460
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C1CN(C(=O)C1)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 C24H25N3O5 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O5/c28-22-3-1-2-19-16-8-15(12-27(19)22)11-25(13-16)24(30)17-9-23(29)26(14-17)18-4-5-20-21(10-18)32-7-6-31-20/h1-5,10,15-17H,6-9,11-14H2/t15-,16+,17?/m0/s1InChIKey
JZMHEXPQRVKICL-RTKIROINSA-NSynonyms
(1R5S)3(1(23dihydrobenzo(b)(14)dioxin6yl)5oxopyrrolidine3carbonyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3((1(23dihydro14benzodioxin6yl)5oxopyrrolidin3yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC24H25N3O5c28223121916815(1227(19)22)1125(1316)24(30)17923(29)26(1417)18452021(1018)32763120h15101517H691114H2t1516+17?m0s1
O=C(N1C(C@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)(C@H)1CN(C(=O)C1)c1ccc2c(c1)OCCO2
ZINC000299754403
ZINC000299754404
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