Vitas-M small molecule compound
[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,1-dioxido-4H-1,4-benzothiazin-2-yl](2,4-dimethylphenyl)methanone
Catalog ID
STL095342
SMILES Cc1ccc(c(c1)C)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 C25H21NO5S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO5S/c1-16-7-9-19(17(2)13-16)25(27)24-15-26(20-5-3-4-6-23(20)32(24,28)29)18-8-10-21-22(14-18)31-12-11-30-21/h3-10,13-15H,11-12H2,1-2H3InChIKey
SJEXIOUGGFWGLL-UHFFFAOYSA-NSynonyms
1114649-24-9(4(23dihydro14benzodioxin6yl)11dioxido4H14benzothiazin2yl)(24dimethylphenyl)methanone
(4(23dihydro14benzodioxin6yl)11dioxo1$l^(6)4benzothiazin2yl)(24dimethylphenyl)methanone
(4(23DIHYDROBENZO(B)(14)DIOXIN6YL)11DIOXIDO4HBENZO(B)(14)THIAZIN2YL)(24DIMETHYLPHENYL)METHANONE
1114649249
CC1=CC(=C(C=C1)C(=O)C2=CN(C3=CC=CC=C3S2(=O)=O)C4=CC5=C(C=C4)OCCO5)C
InChI=1SC25H21NO5Sc1167919(17(2)1316)25(27)241526(20534623(20)32(2428)29)188102122(1418)3112113021h3101315H1112H212H3
MFCD14953401
ZINC000032984267
ZINC32984267
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