Vitas-M small molecule compound
2-[(3,4-dimethylbenzyl)sulfanyl]-6-(4-methylbenzyl)-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125919
SMILES Cc1ccc(cc1)CN1c2ccccc2c2c(S1(=O)=O)cnc(n2)SCc1ccc(c(c1)C)C
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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 C27H25N3O2S2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O2S2/c1-18-8-11-21(12-9-18)16-30-24-7-5-4-6-23(24)26-25(34(30,31)32)15-28-27(29-26)33-17-22-13-10-19(2)20(3)14-22/h4-15H,16-17H2,1-3H3InChIKey
GLUNMJCIRMHXNM-UHFFFAOYSA-NSynonyms
2((34dimethylbenzyl)sulfanyl)6(4methylbenzyl)6Hpyrimido(54c)(21)benzothiazine55dioxide
2((34dimethylphenyl)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)C)C
InChI=1SC27H25N3O2S2c11881121(12918)163024754623(24)2625(34(3031)32)152827(2926)331722131019(2)20(3)1422h415H1617H213H3
MFCD20738345
ZINC000067260154
ZINC67260154
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