Vitas-M small molecule compound
(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK112221
SMILES CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(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 C20H17NO5S2 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5S2/c1-2-24-16-7-12(3-5-14(16)22)9-18-19(23)21(20(27)28-18)10-13-4-6-15-17(8-13)26-11-25-15/h3-9,22H,2,10-11H2,1H3/b18-9-InChIKey
ZKHJUUXDEOPFAE-NVMNQCDNSA-NSynonyms
(5Z)3(13BENZODIOXOL5YLMETHYL)5((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(13BENZODIOXOL5YLMETHYL)5(3ETHOXY4HYDROXYBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC4=C(C=C3)OCO4)O
CCOc1cc(ccc1O)C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
InChI=1SC20H17NO5S2c122416712(3514(16)22)91819(23)21(20(27)2818)1013461517(813)26112515h3922H21011H21H3b189
MFCD03213069
ZINC000004689633
ZINC04689633
ZINC4689633
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