Vitas-M small molecule compound
2-[(2-fluorobenzyl)sulfanyl]-6-(4-methylbenzyl)-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125924
SMILES Cc1ccc(cc1)CN1c2ccccc2c2c(S1(=O)=O)cnc(n2)SCc1ccccc1F
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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/c1-17-10-12-18(13-11-17)15-29-22-9-5-3-7-20(22)24-23(33(29,30)31)14-27-25(28-24)32-16-19-6-2-4-8-21(19)26/h2-14H,15-16H2,1H3InChIKey
QNUSVGRWYGWGHV-UHFFFAOYSA-NSynonyms
2((2fluorobenzyl)sulfanyl)6(4methylbenzyl)6Hpyrimido(54c)(21)benzothiazine55dioxide
2((2fluorophenyl)methylsulfanyl)6((4methylphenyl)methyl)pyrimido(54c)(21)benzothiazine55dioxide
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C4=NC(=NC=C4S2(=O)=O)SCC5=CC=CC=C5F
InChI=1SC25H20FN3O2S2c117101218(131117)152922953720(22)2423(33(2930)31)142725(2824)321619624821(19)26h214H1516H21H3
MFCD20738350
ZINC000067260164
ZINC67260164
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