Vitas-M small molecule compound

[4-(2,6-dichlorobenzyl)piperazin-1-yl](4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone

Catalog ID
STL175046
SMILES O=C(c1cc2c(s1)CCCC2)N1CCN(CC1)Cc1c(Cl)cccc1Cl

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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 C20H22Cl2N2OS MW 409.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22Cl2N2OS/c21-16-5-3-6-17(22)15(16)13-23-8-10-24(11-9-23)20(25)19-12-14-4-1-2-7-18(14)26-19/h3,5-6,12H,1-2,4,7-11,13H2
InChIKey
GOHWHSFOADLMFL-UHFFFAOYSA-N
Synonyms
938000-80-7
(4((26dichlorophenyl)methyl)piperazin1yl)(4567tetrahydro1benzothiophen2yl)methanone
(4(26dichlorobenzyl)piperazin1yl)(4567tetrahydro1benzothiophen2yl)methanone
938000807
C1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)CC4=C(C=CC=C4Cl)Cl
InChI=1SC20H22Cl2N2OSc211653617(22)15(16)132381024(11923)20(25)191214412718(14)2619h35612H12471113H2
MFCD08557684
ZINC000020606447
ZINC20606447

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Available files

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