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Vitas-M small molecule compound

ethyl 1-benzyl-5-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-2-hydroxypropoxy]-2-methyl-1H-indole-3-carboxylate

Catalog ID
STK927754
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(Cn1nc(cc1C)C)O)cc2)Cc1ccccc1

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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 C27H31N3O4 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4/c1-5-33-27(32)26-20(4)29(15-21-9-7-6-8-10-21)25-12-11-23(14-24(25)26)34-17-22(31)16-30-19(3)13-18(2)28-30/h6-14,22,31H,5,15-17H2,1-4H3
InChIKey
BXPZTXRUOVIUGB-UHFFFAOYSA-N
Synonyms

1BENZYL5(3(35DIMETHYLPYRAZOL1YL)2HYDROXYPROPOXY)2METHYL1HINDOLE3CARBOXYLICACIDETHYLESTER
1BENZYL5(3(35DIMETHYLPYRAZOL1YL)2HYDROXYPROPOXY)2METHYLINDOLE3CARBOXYLICACIDETHYLESTER
5(3(35DIMETHYL1PYRAZOLYL)2HYDROXYPROPOXY)2METHYL1(PHENYLMETHYL)3INDOLECARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C(=CC(=N3)C)C)O)CC4=CC=CC=C4)C
ethyl1benzyl5(3(35dimethyl1Hpyrazol1yl)2hydroxypropoxy)2methyl1Hindole3carboxylate
ETHYL1BENZYL5(3(35DIMETHYLPYRAZOL1YL)2HYDROXYPROPOXY)2METHYLINDOLE3CARBOXYLATE
ETHYL5(3(35DIMETHYLPYRAZOL1YL)2OXIDANYLPROPOXY)2METHYL1(PHENYLMETHYL)INDOLE3CARBOXYLATE
ETHYL5(3(35DIMETHYLPYRAZOLYL)2HYDROXYPROPOXY)2METHYL1BENZYLINDOLE3CARBOXYLATE
InChI=1SC27H31N3O4c153327(32)2620(4)29(152197681021)25121123(1424(25)26)341722(31)163019(3)1318(2)2830h6142231H51517H214H3
MFCD03130659
ZINC000000779973
ZINC000000779974

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Available files

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