Vitas-M small molecule compound

(5E)-5-(3-chloro-4-{2-[4-(hexyloxy)phenoxy]ethoxy}-5-methoxybenzylidene)-3-phenyl-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK385568
SMILES CCCCCCOc1ccc(cc1)OCCOc1c(Cl)cc(cc1OC)/C=C\1/SC(=S)N(C1=O)c1ccccc1

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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 C31H32ClNO5S2 MW 598.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32ClNO5S2/c1-3-4-5-9-16-36-24-12-14-25(15-13-24)37-17-18-38-29-26(32)19-22(20-27(29)35-2)21-28-30(34)33(31(39)40-28)23-10-7-6-8-11-23/h6-8,10-15,19-21H,3-5,9,16-18H2,1-2H3/b28-21+
InChIKey
LYNSYULCZFTNKZ-SGWCAAJKSA-N
Synonyms

(5E)5((3chloro4(2(4hexoxyphenoxy)ethoxy)5methoxyphenyl)methylidene)3phenyl2sulfanylidene13thiazolidin4one
(5E)5(3CHLORO4(2(4(HEXYLOXY)PHENOXY)ETHOXY)5METHOXYBENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
5((3CHLORO4(2(4HEXYLOXYPHENOXY)ETHOXY)5METHOXYPHENYL)METHYLENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Cl)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4)OC
CCCCCCOc1ccc(cc1)OCCOc1c(Cl)cc(cc1OC)C=C1SC(=S)N(C1=O)c1ccccc1
InChI=1SC31H32ClNO5S2c13459163624121425(151324)371718382926(32)1922(2027(29)352)212830(34)33(31(39)4028)23107681123h6810151921H3591618H212H3b2821+
MFCD02122875
ZINC000059222157
ZINC59222157

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Available files

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