Vitas-M small molecule compound
9-chloro-2-[(2,5-dimethylbenzyl)sulfanyl]-6-methyl-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125887
SMILES Cc1ccc(c(c1)CSc1ncc2c(n1)c1cc(Cl)ccc1N(S2(=O)=O)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 C20H18ClN3O2S2 MW 431.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O2S2/c1-12-4-5-13(2)14(8-12)11-27-20-22-10-18-19(23-20)16-9-15(21)6-7-17(16)24(3)28(18,25)26/h4-10H,11H2,1-3H3InChIKey
PDQVLQHJIAUMQS-UHFFFAOYSA-NSynonyms
9chloro2((25dimethylbenzyl)sulfanyl)6methyl6Hpyrimido(54c)(21)benzothiazine55dioxide
9chloro2((25dimethylphenyl)methylsulfanyl)6methylpyrimido(54c)(21)benzothiazine55dioxide
CC1=CC(=C(C=C1)C)CSC2=NC=C3C(=N2)C4=C(C=CC(=C4)Cl)N(S3(=O)=O)C
InChI=1SC20H18ClN3O2S2c1124513(2)14(812)11272022101819(2320)16915(21)6717(16)24(3)28(1825)26h410H11H213H3
MFCD20738313
ZINC000067260096
ZINC67260096
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