Vitas-M small molecule compound
9-chloro-2-[(2-chloro-4-fluorobenzyl)sulfanyl]-6-methyl-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125906
SMILES Fc1ccc(c(c1)Cl)CSc1ncc2c(n1)c1cc(Cl)ccc1N(S2(=O)=O)C
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H12Cl2FN3O2S2 MW 456.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12Cl2FN3O2S2/c1-24-15-5-3-11(19)6-13(15)17-16(28(24,25)26)8-22-18(23-17)27-9-10-2-4-12(21)7-14(10)20/h2-8H,9H2,1H3InChIKey
ITIRAZUQGZHBPM-UHFFFAOYSA-NSynonyms
9chloro2((2chloro4fluorobenzyl)sulfanyl)6methyl6Hpyrimido(54c)(21)benzothiazine55dioxide
9chloro2((2chloro4fluorophenyl)methylsulfanyl)6methylpyrimido(54c)(21)benzothiazine55dioxide
CN1C2=C(C=C(C=C2)Cl)C3=NC(=NC=C3S1(=O)=O)SCC4=C(C=C(C=C4)F)Cl
InChI=1SC18H12Cl2FN3O2S2c124155311(19)613(15)1716(28(2425)26)82218(2317)279102412(21)714(10)20h28H9H21H3
MFCD20738332
ZINC000067260126
ZINC67260126
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