Vitas-M small molecule compound
2-[5-(benzyloxy)-1H-indol-1-yl]-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]acetamide
Catalog ID
STL539340
SMILES O=C(Cn1ccc2c1ccc(c2)OCc1ccccc1)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C27H33N3O2 MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O2/c31-27(28-18-23-9-6-15-29-14-5-4-10-25(23)29)19-30-16-13-22-17-24(11-12-26(22)30)32-20-21-7-2-1-3-8-21/h1-3,7-8,11-13,16-17,23,25H,4-6,9-10,14-15,18-20H2,(H,28,31)/t23-,25+/m0/s1InChIKey
PWTXOOFLGULREE-UKILVPOCSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(5phenylmethoxyindol1yl)acetamide
2(5(benzyloxy)1Hindol1yl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)acetamide
2(5(benzyloxy)1Hindol1yl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)acetamide
71754299
InChI=1SC27H33N3O2c3127(28182396152914541025(23)29)19301613221724(111226(22)30)3220217213821h1378111316172325H4691014151820H2(H2831)t2325+m0s1
O=C(Cn1ccc2c1ccc(c2)OCc1ccccc1)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000085874859
ZINC85874859
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