Vitas-M small molecule compound
N-[1,1-dioxido-2-pentyl-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl]-4-methylbenzamide
Catalog ID
STL352685
SMILES CCCCCN1C(=C(NC(=O)c2ccc(cc2)C)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1
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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 C28H28N2O4S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4S/c1-3-4-10-19-30-26(27(31)21-11-6-5-7-12-21)25(23-13-8-9-14-24(23)35(30,33)34)29-28(32)22-17-15-20(2)16-18-22/h5-9,11-18H,3-4,10,19H2,1-2H3,(H,29,32)InChIKey
IDQMTEPYSNNHKH-UHFFFAOYSA-NSynonyms
586985-82-2586985822
CCCCCN1C(=C(C2=CC=CC=C2S1(=O)=O)NC(=O)C3=CC=C(C=C3)C)C(=O)C4=CC=CC=C4
InChI=1SC28H28N2O4Sc13410193026(27(31)21116571221)25(2313891424(23)35(3033)34)2928(32)22171520(2)161822h591118H341019H212H3(H2932)
MFCD04031939
N(11dioxido2pentyl3(phenylcarbonyl)2H12benzothiazin4yl)4methylbenzamide
N(3benzoyl11dioxido2pentyl2Hbenzo(e)(12)thiazin4yl)4methylbenzamide
N(3benzoyl11dioxo2pentyl1$l^(6)2benzothiazin4yl)4methylbenzamide
ZINC000002394942
ZINC02394942
ZINC2394942
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