Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carboxamide
Catalog ID
STL511607
SMILES O=C(N1CCCC2=CC3CC(C12)CN1CCCCC31)NCC1COc2c(O1)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 C25H33N3O3 MW 423.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O3/c29-25(26-14-20-16-30-22-8-1-2-9-23(22)31-20)28-11-5-6-17-12-18-13-19(24(17)28)15-27-10-4-3-7-21(18)27/h1-2,8-9,12,18-21,24H,3-7,10-11,13-16H2,(H,26,29)InChIKey
BFELMUXVWRRXHS-UHFFFAOYSA-NSynonyms
(6S6aS13S13aR)N((23dihydrobenzo(b)(14)dioxin2yl)methyl)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocine1carboxamide
~(N)(23dihydro14benzodioxin3ylmethyl)315diazatetracyclo(7710^(27)0^(1015))heptadec7ene3carboxamide
135638036
InChI=1SC25H33N3O3c2925(261420163022812923(22)3120)2811561712181319(24(17)28)15271043721(18)27h128912182124H3710111316H2(H2629)
MFCD31751727
N(23dihydro14benzodioxin2ylmethyl)34678910121313adecahydro2H613methanodipyrido(12a32e)azocine1(6aH)carboxamide
O=C(N1CCCC2=C(C@H)3C(C@H)((C@H)12)CN1CCCC(C@@H)31)NC(C@H)1COc2c(O1)cccc2
ZINC000886025157
ZINC000886025163
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