Vitas-M small molecule compound

(1-benzyl-1H-indol-2-yl)[4-(methylsulfonyl)piperazin-1-yl]methanone

Catalog ID
STK642980
SMILES O=C(c1cc2c(n1Cc1ccccc1)cccc2)N1CCN(CC1)S(=O)(=O)C

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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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-28(26,27)23-13-11-22(12-14-23)21(25)20-15-18-9-5-6-10-19(18)24(20)16-17-7-3-2-4-8-17/h2-10,15H,11-14,16H2,1H3
InChIKey
IWHFTYVTNWISKD-UHFFFAOYSA-N
Synonyms
1081117-59-0
(1benzyl1Hindol2yl)(4(methylsulfonyl)piperazin1yl)methanone
(1benzylindol2yl)(4methylsulfonylpiperazin1yl)methanone
1081117590
CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2CC4=CC=CC=C4
InChI=1SC21H23N3O3Sc128(2627)23131122(121423)21(25)2015189561019(18)24(20)16177324817h21015H111416H21H3
MFCD12210540
ZINC000020745819
ZINC20745819

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.