Vitas-M small molecule compound
2-[(4-fluorobenzyl)sulfanyl]-6-(4-methylbenzyl)-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125926
SMILES Cc1ccc(cc1)CN1c2ccccc2c2c(S1(=O)=O)cnc(n2)SCc1ccc(cc1)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 C25H20FN3O2S2 MW 477.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN3O2S2/c1-17-6-8-18(9-7-17)15-29-22-5-3-2-4-21(22)24-23(33(29,30)31)14-27-25(28-24)32-16-19-10-12-20(26)13-11-19/h2-14H,15-16H2,1H3InChIKey
IGPJLIJSEVNVLS-UHFFFAOYSA-NSynonyms
2((4fluorobenzyl)sulfanyl)6(4methylbenzyl)6Hpyrimido(54c)(21)benzothiazine55dioxide
2((4fluorophenyl)methylsulfanyl)6((4methylphenyl)methyl)pyrimido(54c)(21)benzothiazine55dioxide
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C4=NC(=NC=C4S2(=O)=O)SCC5=CC=C(C=C5)F
InChI=1SC25H20FN3O2S2c1176818(9717)152922532421(22)2423(33(2930)31)142725(2824)321619101220(26)131119h214H1516H21H3
MFCD20738352
ZINC000067260167
ZINC67260167
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