Vitas-M small molecule compound

2-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioic acid

Catalog ID
STK601114
SMILES OC(=O)CC(N1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O)C(=O)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 C15H11NO7S2 MW 381.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11NO7S2/c17-12(18)5-8(14(20)21)16-13(19)11(25-15(16)24)4-7-1-2-9-10(3-7)23-6-22-9/h1-4,8H,5-6H2,(H,17,18)(H,20,21)/b11-4-
InChIKey
MOVUGJQPYGHZNW-WCIBSUBMSA-N
Synonyms
872696-44-1
(Z)2(5(benzo(d)(13)dioxol5ylmethylene)4oxo2thioxothiazolidin3yl)succinicacid
2((5Z)5(13BENZODIOXOL5YLMETHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANEDIOICACID
2((5Z)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)butanedioicacid
2(5(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANEDIOICACID
872696441
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O
InChI=1SC15H11NO7S2c1712(18)58(14(20)21)1613(19)11(2515(16)24)4712910(37)236229h148H56H2(H1718)(H2021)b114
MFCD06737640
OC(=O)CC(N1C(=S)SC(=Cc2ccc3c(c2)OCO3)C1=O)C(=O)O
ZINC000004357092
ZINC000004357095

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Available files

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