Vitas-M small molecule compound
5-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-hydroxybenzoic acid
Catalog ID
STK926495
SMILES S=C1S/C(=C/c2ccc3c(c2)OCO3)/C(=O)N1c1ccc(c(c1)C(=O)O)O
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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 C18H11NO6S2 MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11NO6S2/c20-12-3-2-10(7-11(12)17(22)23)19-16(21)15(27-18(19)26)6-9-1-4-13-14(5-9)25-8-24-13/h1-7,20H,8H2,(H,22,23)/b15-6+InChIKey
VGRLLQCDIPPIMD-GIDUJCDVSA-NSynonyms
5((5E)5(13benzodioxol5ylmethylidene)4oxo2sulfanylidene13thiazolidin3yl)2hydroxybenzoicacid
5((5E)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)2hydroxybenzoicacid
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC(=C(C=C4)O)C(=O)O
InChI=1SC18H11NO6S2c20123210(711(12)17(22)23)1916(21)15(2718(19)26)69141314(59)2582413h1720H8H2(H2223)b156+
MFCD18175961
S=C1SC(=Cc2ccc3c(c2)OCO3)C(=O)N1c1ccc(c(c1)C(=O)O)O
ZINC000027530379
ZINC27530379
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