Vitas-M small molecule compound

3-{(3,4-dimethoxybenzyl)[2-(1,2,5-trimethyl-4-phenylpiperidin-4-yl)ethyl]amino}propanenitrile

Catalog ID
STK531484
SMILES N#CCCN(Cc1ccc(c(c1)OC)OC)CCC1(CC(C)N(CC1C)C)c1ccccc1

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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 C28H39N3O2 MW 449.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H39N3O2/c1-22-20-30(3)23(2)19-28(22,25-10-7-6-8-11-25)14-17-31(16-9-15-29)21-24-12-13-26(32-4)27(18-24)33-5/h6-8,10-13,18,22-23H,9,14,16-17,19-21H2,1-5H3
InChIKey
RRSOUPVPFREUEZ-UHFFFAOYSA-N
Synonyms

3((34dimethoxybenzyl)(2(125trimethyl4phenylpiperidin4yl)ethyl)amino)propanenitrile
3((34dimethoxybenzyl)(2(125trimethyl4phenylpiperidin4yl)ethyl)amino)propanenitriledihydrochloride
3((34DIMETHOXYPHENYL)METHYL(2(125TRIMETHYL4PHENYLPIPERIDIN4YL)ETHYL)AMINO)PROPANENITRILE
CC1CC(C(CN1C)C)(CCN(CCC#N)CC2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3
InChI=1SC28H39N3O2c1222030(3)23(2)1928(2225107681125)141731(1691529)2124121326(324)27(1824)335h681013182223H91416171921H215H3
MFCD00319673
N#CCCN(Cc1ccc(c(c1)OC)OC)CCC1(CC(C)N(CC1C)C)c1ccccc1ClCl
ZINC000009070952
ZINC000239403282

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Available files

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