Vitas-M small molecule compound

6-[(5E)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid

Catalog ID
STK711029
SMILES OC(=O)CCCCCN1C(=S)S/C(=C/c2ccccc2)/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 C16H17NO3S2 MW 335.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO3S2/c18-14(19)9-5-2-6-10-17-15(20)13(22-16(17)21)11-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,18,19)/b13-11+
InChIKey
RBQYTRMRAMKNBT-ACCUITESSA-N
Synonyms

(Z)6(5benzylidene4oxo2thioxothiazolidin3yl)hexanoicacid
6((5E)5BENZYLIDENE4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
6((5E)5benzylidene4oxo2thioxo13thiazolidin3yl)hexanoicacid
6(5BENZYLIDENE4OXO2THIOXOTHIAZOLIDIN3YL)HEXANOICACID
C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O
InChI=1SC16H17NO3S2c1814(19)9526101715(20)13(2216(17)21)11127314812h1347811H256910H2(H1819)b1311+
MFCD00193759
OC(=O)CCCCCN1C(=S)SC(=Cc2ccccc2)C1=O
ZINC000001907699
ZINC1907699

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Available files

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