Vitas-M small molecule compound
4-(2-benzyl-1,1-dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)phenyl benzoate
Catalog ID
STL061625
SMILES O=C(c1ccccc1)Oc1ccc(cc1)C1Nc2ccccc2S(=O)(=O)N1Cc1ccccc1
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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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c30-27(22-11-5-2-6-12-22)33-23-17-15-21(16-18-23)26-28-24-13-7-8-14-25(24)34(31,32)29(26)19-20-9-3-1-4-10-20/h1-18,26,28H,19H2InChIKey
CZYNMQDXLBBVRO-UHFFFAOYSA-NSynonyms
(4(2benzyl11dioxo34dihydro1$l^(6)24benzothiadiazin3yl)phenyl)benzoate
4(2benzyl11dioxido34dihydro2H124benzothiadiazin3yl)phenylbenzoate
C1=CC=C(C=C1)CN2C(NC3=CC=CC=C3S2(=O)=O)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5
InChI=1SC27H22N2O4Sc3027(22115261222)3323171521(161823)26282413781425(24)34(3132)29(26)192093141020h1182628H19H2
MFCD03828402
ZINC000003633515
ZINC000003633517
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