Vitas-M small molecule compound
(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(4-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK060206
SMILES COc1ccc(cc1)N1C(=S)S/C(=C\c2cc3OCOc3cc2Br)/C1=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 C18H12BrNO4S2 MW 450.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrNO4S2/c1-22-12-4-2-11(3-5-12)20-17(21)16(26-18(20)25)7-10-6-14-15(8-13(10)19)24-9-23-14/h2-8H,9H2,1H3/b16-7-InChIKey
AIZRLNJNQYYVSQ-APSNUPSMSA-NSynonyms
(5Z)5((6BROMO13BENZODIOXOL5YL)METHYLIDENE)3(4METHOXYPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5((6BROMO13BENZODIOXOL5YL)METHYLIDENE)3(4METHOXYPHENYL)2THIOXO13THIAZOLIDIN4ONE
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3Br)OCO4)SC2=S
COc1ccc(cc1)N1C(=S)SC(=Cc2cc3OCOc3cc2Br)C1=O
InChI=1SC18H12BrNO4S2c122124211(3512)2017(21)16(2618(20)25)71061415(813(10)19)2492314h28H9H21H3b167
MFCD01469686
STK060206
ZINC000001188359
ZINC01188359
ZINC1188359
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