Vitas-M small molecule compound
2-[(2,5-dimethylbenzyl)sulfanyl]-6-(4-methylbenzyl)-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125918
SMILES Cc1ccc(cc1)CN1c2ccccc2c2c(S1(=O)=O)cnc(n2)SCc1cc(C)ccc1C
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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/c1-18-9-12-21(13-10-18)16-30-24-7-5-4-6-23(24)26-25(34(30,31)32)15-28-27(29-26)33-17-22-14-19(2)8-11-20(22)3/h4-15H,16-17H2,1-3H3InChIKey
RDQPBXBKSLYVRE-UHFFFAOYSA-NSynonyms
2((25dimethylbenzyl)sulfanyl)6(4methylbenzyl)6Hpyrimido(54c)(21)benzothiazine55dioxide
2((25dimethylphenyl)methylsulfanyl)6((4methylphenyl)methyl)pyrimido(54c)(21)benzothiazine55dioxide
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C4=NC(=NC=C4S2(=O)=O)SCC5=C(C=CC(=C5)C)C
InChI=1SC27H25N3O2S2c11891221(131018)163024754623(24)2625(34(3031)32)152827(2926)3317221419(2)81120(22)3h415H1617H213H3
MFCD20738344
ZINC000067260152
ZINC67260152
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