Vitas-M small molecule compound

1-(4-{2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethoxy}-3-methoxyphenyl)ethanone

Catalog ID
STK625759
SMILES COc1cc(ccc1OCCN1CCC(CC1)c1nc2c(s1)cccc2)C(=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 C23H26N2O3S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O3S/c1-16(26)18-7-8-20(21(15-18)27-2)28-14-13-25-11-9-17(10-12-25)23-24-19-5-3-4-6-22(19)29-23/h3-8,15,17H,9-14H2,1-2H3
InChIKey
JWBUCJFJTJGNBJ-UHFFFAOYSA-N
Synonyms
929967-56-6
1(4(2(4(13benzothiazol2yl)piperidin1yl)ethoxy)3methoxyphenyl)ethanone
1(4(2(4(benzo(d)thiazol2yl)piperidin1yl)ethoxy)3methoxyphenyl)ethanone
929967566
CC(=O)C1=CC(=C(C=C1)OCCN2CCC(CC2)C3=NC4=CC=CC=C4S3)OC
InChI=1SC23H26N2O3Sc116(26)187820(21(1518)272)2814132511917(101225)232419534622(19)2923h381517H914H212H3
MFCD09849250
ZINC000009052932
ZINC9052932

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Available files

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