Vitas-M small molecule compound

2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone

Catalog ID
STK858630
SMILES CCOc1ccc2c(c1)sc(n2)SCC(=O)N1CCN(CC1)c1ccccc1

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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 C21H23N3O2S2 MW 413.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S2/c1-2-26-17-8-9-18-19(14-17)28-21(22-18)27-15-20(25)24-12-10-23(11-13-24)16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3
InChIKey
OUGIJIYKCDWCHD-UHFFFAOYSA-N
Synonyms
488795-48-8
2((6ethoxy13benzothiazol2yl)sulfanyl)1(4phenylpiperazin1yl)ethanone
2((6ethoxybenzo(d)thiazol2yl)thio)1(4phenylpiperazin1yl)ethanone
488795488
CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCN(CC3)C4=CC=CC=C4
InChI=1SC21H23N3O2S2c122617891819(1417)2821(2218)271520(25)24121023(111324)166435716h3914H2101315H21H3
MFCD03292773
ZINC000001165420
ZINC01165420
ZINC1165420

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Available files

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