Vitas-M small molecule compound
2-(9-bromo-5,5-dioxido-6H-dibenzo[c,e][1,2]thiazin-6-yl)-N-cycloheptylacetamide
Catalog ID
STL138277
SMILES O=C(CN1c2ccc(cc2c2c(S1(=O)=O)cccc2)Br)NC1CCCCCC1
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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 C21H23BrN2O3S MW 463.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN2O3S/c22-15-11-12-19-18(13-15)17-9-5-6-10-20(17)28(26,27)24(19)14-21(25)23-16-7-3-1-2-4-8-16/h5-6,9-13,16H,1-4,7-8,14H2,(H,23,25)InChIKey
KVNHHAJEVYNISI-UHFFFAOYSA-NSynonyms
2(9bromo55dioxido6Hdibenzo(ce)(12)thiazin6yl)Ncycloheptylacetamide
2(9bromo55dioxobenzo(c)(12)benzothiazin6yl)Ncycloheptylacetamide
C1CCCC(CC1)NC(=O)CN2C3=C(C=C(C=C3)Br)C4=CC=CC=C4S2(=O)=O
InChI=1SC21H23BrN2O3Sc221511121918(1315)179561020(17)28(2627)24(19)1421(25)231673124816h5691316H147814H2(H2325)
MFCD09219363
ZINC000011121069
ZINC11121069
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