Vitas-M small molecule compound
ethyl 4-({5,7,8-trifluoro-4-[3-(morpholin-4-yl)propyl]-1,1-dioxido-3,4-dihydro-2H-1,4-benzothiazin-6-yl}carbonyl)piperazine-1-carboxylate
Catalog ID
STK636435
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1c(F)c2N(CCCN3CCOCC3)CCS(=O)(=O)c2c(c1F)F
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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 C23H31F3N4O6S MW 548.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31F3N4O6S/c1-2-36-23(32)30-8-6-29(7-9-30)22(31)16-17(24)19(26)21-20(18(16)25)28(12-15-37(21,33)34)5-3-4-27-10-13-35-14-11-27/h2-15H2,1H3InChIKey
ZZPDOODHLWIILJ-UHFFFAOYSA-NSynonyms
1010906-99-61010906996
CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(C(=C2F)F)S(=O)(=O)CCN3CCCN4CCOCC4)F
ethyl4((578trifluoro4(3(morpholin4yl)propyl)11dioxido34dihydro2H14benzothiazin6yl)carbonyl)piperazine1carboxylate
ethyl4(578trifluoro4(3morpholin4ylpropyl)11dioxo23dihydro1$l^(6)4benzothiazine6carbonyl)piperazine1carboxylate
ethyl4(578trifluoro4(3morpholinopropyl)11dioxido34dihydro2Hbenzo(b)(14)thiazine6carbonyl)piperazine1carboxylate
InChI=1SC23H31F3N4O6Sc123623(32)308629(7930)22(31)1617(24)19(26)2120(18(16)25)28(121537(2133)34)53427101335141127h215H21H3
MFCD12201440
ZINC000101524662
ZINC101524662
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