Vitas-M small molecule compound
2-{[6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK677275
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc2c(s1)cc(cc2)N1C(=O)C2C(C1=O)C1CC2C=C1
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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 C25H18F3N3O3S2 MW 529.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18F3N3O3S2/c26-25(27,28)14-2-1-3-15(9-14)29-19(32)11-35-24-30-17-7-6-16(10-18(17)36-24)31-22(33)20-12-4-5-13(8-12)21(20)23(31)34/h1-7,9-10,12-13,20-21H,8,11H2,(H,29,32)InChIKey
RWMDITQNAVQVGY-UHFFFAOYSA-NSynonyms
2((6(13dioxo133a477ahexahydro2H47methanoisoindol2yl)13benzothiazol2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC5=C(C=C4)N=C(S5)SCC(=O)NC6=CC=CC(=C6)C(F)(F)F
InChI=1SC25H18F3N3O3S2c2625(2728)1421315(914)2919(32)11352430177616(1018(17)3624)3122(33)20124513(812)21(20)23(31)34h1791012132021H811H2(H2932)
MFCD02019303
ZINC000100101234
ZINC000102994748
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