Vitas-M small molecule compound

1-(4-{2-hydroxy-3-[4-(piperidin-1-ylsulfonyl)piperazin-1-yl]propoxy}phenyl)propan-1-one

Catalog ID
STK227863
SMILES CCC(=O)c1ccc(cc1)OCC(CN1CCN(CC1)S(=O)(=O)N1CCCCC1)O

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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 C21H33N3O5S MW 439.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H33N3O5S/c1-2-21(26)18-6-8-20(9-7-18)29-17-19(25)16-22-12-14-24(15-13-22)30(27,28)23-10-4-3-5-11-23/h6-9,19,25H,2-5,10-17H2,1H3
InChIKey
YFKOYNBRWMRWKM-UHFFFAOYSA-N
Synonyms
825607-89-4
1(4(2HYDROXY3(4(1PIPERIDINYLSULFONYL)1PIPERAZINYL)PROPOXY)PHENYL)1PROPANONE
1(4(2HYDROXY3(4(PIPERIDIN1YLSULFONYL)PIPERAZIN1YL)PROPOXY)PHENYL)PROPAN1ONE
1(4(2HYDROXY3(4(PIPERIDYLSULFONYL)PIPERAZINYL)PROPOXY)PHENYL)PROPAN1ONE
1(4(2HYDROXY3(4PIPERIDIN1YLSULFONYLPIPERAZIN1YL)PROPOXY)PHENYL)PROPAN1ONE
825607894
CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)N3CCCCC3)O
InChI=1SC21H33N3O5Sc1221(26)186820(9718)291719(25)1622121424(151322)30(2728)23104351123h691925H251017H21H3
MFCD06590690
ZINC000019908986
ZINC000019908988

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Available files

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