Vitas-M small molecule compound

1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]piperazine

Catalog ID
STK735401
SMILES [O-][N+](=O)c1ccc(cc1)c1csc(n1)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)OCCO2

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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 C21H20N4O6S2 MW 488.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O6S2/c26-25(27)16-3-1-15(2-4-16)18-14-32-21(22-18)23-7-9-24(10-8-23)33(28,29)17-5-6-19-20(13-17)31-12-11-30-19/h1-6,13-14H,7-12H2
InChIKey
DIGLRLWVEVCCBT-UHFFFAOYSA-N
Synonyms
904008-26-0
(O)(N+)(=O)c1ccc(cc1)c1csc(n1)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)OCCO2
1(23dihydro14benzodioxin6ylsulfonyl)4(4(4nitrophenyl)13thiazol2yl)piperazine
2(4((23dihydrobenzo(b)(14)dioxin6yl)sulfonyl)piperazin1yl)4(4nitrophenyl)thiazole
2(4(23dihydro14benzodioxin6ylsulfonyl)piperazin1yl)4(4nitrophenyl)13thiazole
6((4(4(4NITROPHENYL)13THIAZOL2YL)PIPERAZINYL)SULFONYL)2H3HBENZO(E)14DIOXIN
904008260
C1CN(CCN1C2=NC(=CS2)C3=CC=C(C=C3)(N+)(=O)(O))S(=O)(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC21H20N4O6S2c2625(27)163115(2416)18143221(2218)237924(10823)33(2829)17561920(1317)3112113019h161314H712H2
MFCD08285997
ZINC000009164737
ZINC09164737
ZINC9164737

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Available files

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