Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-2-{2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-yl}ethanamine

Catalog ID
STK581726
SMILES CC1(C)OCCC(C1)(CCNCc1ccc2c(c1)OCO2)c1cccc(c1)C(F)(F)F

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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 C24H28F3NO3 MW 435.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28F3NO3/c1-22(2)15-23(9-11-31-22,18-4-3-5-19(13-18)24(25,26)27)8-10-28-14-17-6-7-20-21(12-17)30-16-29-20/h3-7,12-13,28H,8-11,14-16H2,1-2H3
InChIKey
NSPYYTLYXJEXFA-UHFFFAOYSA-N
Synonyms
893687-03-1
893687031
CC1(CC(CCO1)(CCNCC2=CC3=C(C=C2)OCO3)C4=CC(=CC=C4)C(F)(F)F)C
InChI=1SC24H28F3NO3c122(2)1523(91131221843519(1318)24(2526)27)810281417672021(1217)30162920h37121328H8111416H212H3
MFCD06775928
N(13BENZODIOXOL5YLMETHYL)2(22DIMETHYL4(3(TRIFLUOROMETHYL)PHENYL)OXAN4YL)ETHANAMINE
N(13benzodioxol5ylmethyl)2(22dimethyl4(3(trifluoromethyl)phenyl)tetrahydro2Hpyran4yl)ethanamine
N(benzo(d)(13)dioxol5ylmethyl)2(22dimethyl4(3(trifluoromethyl)phenyl)tetrahydro2Hpyran4yl)ethanamine
ZINC000009452412
ZINC000013555731

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Available files

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