Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{(5E)-5-[4-(dimethylamino)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetamide
Catalog ID
STL375956
SMILES O=C(CN1C(=O)S/C(=C/c2ccc(cc2)N(C)C)/C1=O)Nc1ccc2c(c1)OCO2
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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 C21H19N3O5S MW 425.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5S/c1-23(2)15-6-3-13(4-7-15)9-18-20(26)24(21(27)30-18)11-19(25)22-14-5-8-16-17(10-14)29-12-28-16/h3-10H,11-12H2,1-2H3,(H,22,25)/b18-9+InChIKey
ZPBHGQJMKDJXFI-GIJQJNRQSA-NSynonyms
CN(C)C1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC21H19N3O5Sc123(2)156313(4715)91820(26)24(21(27)3018)1119(25)2214581617(1014)29122816h310H1112H212H3(H2225)b189+
MFCD04311301
N(13benzodioxol5yl)2((5E)5((4(dimethylamino)phenyl)methylidene)24dioxo13thiazolidin3yl)acetamide
N(13benzodioxol5yl)2((5E)5(4(dimethylamino)benzylidene)24dioxo13thiazolidin3yl)acetamide
O=C(CN1C(=O)SC(=Cc2ccc(cc2)N(C)C)C1=O)Nc1ccc2c(c1)OCO2
ZINC000009234652
ZINC09234652
ZINC9234652
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