Vitas-M small molecule compound
2-[(4-methoxybenzyl)sulfanyl]-6-(4-methylbenzyl)-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125922
SMILES COc1ccc(cc1)CSc1ncc2c(n1)c1ccccc1N(S2(=O)=O)Cc1ccc(cc1)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 C26H23N3O3S2 MW 489.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O3S2/c1-18-7-9-19(10-8-18)16-29-23-6-4-3-5-22(23)25-24(34(29,30)31)15-27-26(28-25)33-17-20-11-13-21(32-2)14-12-20/h3-15H,16-17H2,1-2H3InChIKey
HUVTWNUIBZHMKZ-UHFFFAOYSA-NSynonyms
2((4methoxybenzyl)sulfanyl)6(4methylbenzyl)6Hpyrimido(54c)(21)benzothiazine55dioxide
2((4methoxyphenyl)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)OC
InChI=1SC26H23N3O3S2c1187919(10818)162923643522(23)2524(34(2930)31)152726(2825)331720111321(322)141220h315H1617H212H3
MFCD20738348
ZINC000067260160
ZINC67260160
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