Vitas-M small molecule compound

(1-benzyl-1H-indol-3-yl)[4-(methylsulfonyl)piperazin-1-yl]methanone

Catalog ID
STK657441
SMILES O=C(c1cn(c2c1cccc2)Cc1ccccc1)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)24-13-11-22(12-14-24)21(25)19-16-23(15-17-7-3-2-4-8-17)20-10-6-5-9-18(19)20/h2-10,16H,11-15H2,1H3
InChIKey
KIXREGKNXQNNHS-UHFFFAOYSA-N
Synonyms
1144439-37-1
(1benzyl1Hindol3yl)(4(methylsulfonyl)piperazin1yl)methanone
(1benzylindol3yl)(4methylsulfonylpiperazin1yl)methanone
1144439371
CS(=O)(=O)N1CCN(CC1)C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4
InChI=1SC21H23N3O3Sc128(2627)24131122(121424)21(25)191623(15177324817)201065918(19)20h21016H1115H21H3
MFCD12218553
ZINC000026558422
ZINC26558422

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Available files

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