Vitas-M small molecule compound
[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,1-dioxido-4H-1,4-benzothiazin-2-yl](4-ethoxyphenyl)methanone
Catalog ID
STL095364
SMILES CCOc1ccc(cc1)C(=O)C1=CN(c2ccc3c(c2)OCCO3)c2c(S1(=O)=O)cccc2
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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 C25H21NO6S MW 463.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO6S/c1-2-30-19-10-7-17(8-11-19)25(27)24-16-26(20-5-3-4-6-23(20)33(24,28)29)18-9-12-21-22(15-18)32-14-13-31-21/h3-12,15-16H,2,13-14H2,1H3InChIKey
JIGNSOLREBMMFH-UHFFFAOYSA-NSynonyms
1114649-97-6(4(23dihydro14benzodioxin6yl)11dioxido4H14benzothiazin2yl)(4ethoxyphenyl)methanone
(4(23dihydro14benzodioxin6yl)11dioxo1$l^(6)4benzothiazin2yl)(4ethoxyphenyl)methanone
(4(23DIHYDROBENZO(B)(14)DIOXIN6YL)11DIOXIDO4HBENZO(B)(14)THIAZIN2YL)(4ETHOXYPHENYL)METHANONE
1114649976
CCOC1=CC=C(C=C1)C(=O)C2=CN(C3=CC=CC=C3S2(=O)=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC25H21NO6Sc12301910717(81119)25(27)241626(20534623(20)33(2428)29)189122122(1518)3214133121h3121516H21314H21H3
MFCD14953441
ZINC000032984307
ZINC32984307
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