Vitas-M small molecule compound

{4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-3-nitrophenyl}(morpholin-4-yl)methanone

Catalog ID
STK272098
SMILES [O-][N+](=O)c1cc(ccc1N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)N1CCOCC1

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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 C23H26N4O8S MW 518.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O8S/c28-23(25-9-11-33-12-10-25)17-1-3-19(20(15-17)27(29)30)24-5-7-26(8-6-24)36(31,32)18-2-4-21-22(16-18)35-14-13-34-21/h1-4,15-16H,5-14H2
InChIKey
GCMLONQWWQSVKJ-UHFFFAOYSA-N
Synonyms

(4(4(23dihydro14benzodioxin6ylsulfonyl)piperazin1yl)3nitrophenyl)(morpholin4yl)methanone
(4(4(23DIHYDRO14BENZODIOXIN6YLSULFONYL)PIPERAZIN1YL)3NITROPHENYL)MORPHOLIN4YLMETHANONE
(O)(N+)(=O)c1cc(ccc1N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)N1CCOCC1
C1CN(CCN1C2=C(C=C(C=C2)C(=O)N3CCOCC3)(N+)(=O)(O))S(=O)(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC23H26N4O8Sc2823(2591133121025)171319(20(1517)27(29)30)245726(8624)36(3132)18242122(1618)3514133421h141516H514H2
MFCD06616602
ZINC000009614360
ZINC09614360
ZINC9614360

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Available files

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