Vitas-M small molecule compound
3-[4-(3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl)-4-oxobutyl]-1,2,3-benzotriazin-4(3H)-one
Catalog ID
STL577358
SMILES O=C(N1CCCC2=CC3CC(C12)CN1CCCCC31)CCCn1nnc2c(c1=O)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 C26H33N5O2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N5O2/c32-24(11-6-14-31-26(33)21-8-1-2-9-22(21)27-28-31)30-13-5-7-18-15-19-16-20(25(18)30)17-29-12-4-3-10-23(19)29/h1-2,8-9,15,19-20,23,25H,3-7,10-14,16-17H2InChIKey
RDLVOEUEQQBGGJ-UHFFFAOYSA-NSynonyms
3(4((6R13R)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)4oxobutyl)benzo(d)(123)triazin4(3H)one
3(4(34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)yl)4oxobutyl)123benzotriazin4(3H)one
InChI=1SC26H33N5O2c3224(116143126(33)21812922(21)272831)3013571815191620(25(18)30)172912431023(19)29h12891519202325H3710141617H2
MFCD33396807
O=C(N1CCCC2=C(C@H)3C(C@@H)((C@H)12)CN1CCCC(C@H)31)CCCn1nnc2c(c1=O)cccc2
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