Vitas-M small molecule compound

(5Z)-2-(4-{4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperazin-1-yl)-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one

Catalog ID
STK531494
SMILES CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(cc2)OC)/S1

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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 C31H32N4O4S3 MW 620.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N4O4S3/c1-3-21-6-8-22(9-7-21)20-26-29(38)35(31(40)42-26)14-4-5-27(36)33-15-17-34(18-16-33)30-32-28(37)25(41-30)19-23-10-12-24(39-2)13-11-23/h6-13,19-20H,3-5,14-18H2,1-2H3/b25-19-,26-20-
InChIKey
WOJMKTMXAILTAX-DQIQZUARSA-N
Synonyms

(5Z)2(4(4((5Z)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)butanoyl)piperazin1yl)5(4methoxybenzylidene)13thiazol4(5H)one
(5Z)5((4ETHYLPHENYL)METHYLIDENE)3(4(4((5Z)5((4METHOXYPHENYL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERAZIN1YL)4OXOBUTYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)2(4(4((Z)5(4ethylbenzylidene)4oxo2thioxothiazolidin3yl)butanoyl)piperazin1yl)5(4methoxybenzylidene)thiazol4(5H)one
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)N3CCN(CC3)C4=NC(=O)C(=CC5=CC=C(C=C5)OC)S4
CCc1ccc(cc1)C=C1SC(=S)N(C1=O)CCCC(=O)N1CCN(CC1)C1=NC(=O)C(=Cc2ccc(cc2)OC)S1
InChI=1SC31H32N4O4S3c13216822(9721)202629(38)35(31(40)4226)144527(36)33151734(181633)303228(37)25(4130)1923101224(392)131123h6131920H351418H212H3b25192620
MFCD01947291
ZINC000097966385
ZINC97966385

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Available files

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