Vitas-M small molecule compound

(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Catalog ID
STK431763
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)c1csc2c1CCC(C2)C(C)(C)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 C24H32N2O2S MW 412.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O2S/c1-24(2,3)17-5-10-20-21(16-29-22(20)15-17)23(27)26-13-11-25(12-14-26)18-6-8-19(28-4)9-7-18/h6-9,16-17H,5,10-15H2,1-4H3
InChIKey
ODTCDTNIGHFITN-UHFFFAOYSA-N
Synonyms

(6tertbutyl4567tetrahydro1benzothiophen3yl)(4(4methoxyphenyl)piperazin1yl)methanone
CC(C)(C)C1CCC2=C(C1)SC=C2C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC
InChI=1SC24H32N2O2Sc124(23)175102021(162922(20)1517)23(27)26131125(121426)186819(284)9718h691617H51015H214H3
MFCD03074989
ZINC000002754961
ZINC000002754962

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Available files

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