Vitas-M small molecule compound
(5E)-5-{3-chloro-4-[2-(2-chlorophenoxy)ethoxy]-5-ethoxybenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK001351
SMILES C=CCN1C(=S)S/C(=C/c2cc(Cl)c(c(c2)OCC)OCCOc2ccccc2Cl)/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 C23H21Cl2NO4S2 MW 510.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21Cl2NO4S2/c1-3-9-26-22(27)20(32-23(26)31)14-15-12-17(25)21(19(13-15)28-4-2)30-11-10-29-18-8-6-5-7-16(18)24/h3,5-8,12-14H,1,4,9-11H2,2H3/b20-14+InChIKey
CMHXWXWXNFQBFD-XSFVSMFZSA-NSynonyms
(5E)5((3chloro4(2(2chlorophenoxy)ethoxy)5ethoxyphenyl)methylidene)3prop2enyl2sulfanylidene13thiazolidin4one
(5E)5(3CHLORO4(2(2CHLOROPHENOXY)ETHOXY)5ETHOXYBENZYLIDENE)3(PROP2EN1YL)2THIOXO13THIAZOLIDIN4ONE
C=CCN1C(=S)SC(=Cc2cc(Cl)c(c(c2)OCC)OCCOc2ccccc2Cl)C1=O
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC=C)Cl)OCCOC3=CC=CC=C3Cl
InChI=1SC23H21Cl2NO4S2c1392622(27)20(3223(26)31)14151217(25)21(19(1315)2842)3011102918865716(18)24h3581214H14911H22H3b2014+
MFCD08049018
STK001351
ZINC000008916014
ZINC08916014
ZINC8916014
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