Vitas-M small molecule compound
(5Z)-3-ethyl-5-(3-iodo-5-methoxy-4-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK050739
SMILES CCN1C(=S)S/C(=C\c2cc(I)c(c(c2)OC)OCCOc2cc(C)ccc2C(C)C)/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 C25H28INO4S2 MW 597.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28INO4S2/c1-6-27-24(28)22(33-25(27)32)14-17-12-19(26)23(21(13-17)29-5)31-10-9-30-20-11-16(4)7-8-18(20)15(2)3/h7-8,11-15H,6,9-10H2,1-5H3/b22-14-InChIKey
OAHHYCBWNKIGGR-HMAPJEAMSA-NSynonyms
(5Z)3ETHYL5((3IODO5METHOXY4(2(5METHYL2PROPAN2YLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3ETHYL5(3IODO5METHOXY4(2(5METHYL2(PROPAN2YL)PHENOXY)ETHOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCCOC3=C(C=CC(=C3)C)C(C)C)OC)SC1=S
CCN1C(=S)SC(=Cc2cc(I)c(c(c2)OC)OCCOc2cc(C)ccc2C(C)C)C1=O
InChI=1SC25H28INO4S2c162724(28)22(3325(27)32)14171219(26)23(21(1317)295)3110930201116(4)7818(20)15(2)3h781115H6910H215H3b2214
MFCD02109336
STK050739
ZINC000100198650
ZINC100198650
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