Vitas-M small molecule compound

3-{(5Z)-5-[1-(carboxymethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid

Catalog ID
STK701385
SMILES OC(=O)CCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)O)/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 C16H12N2O6S2 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O6S2/c19-10(20)5-6-17-15(24)13(26-16(17)25)12-8-3-1-2-4-9(8)18(14(12)23)7-11(21)22/h1-4H,5-7H2,(H,19,20)(H,21,22)/b13-12-
InChIKey
BJKJQMFIKYKMMU-SEYXRHQNSA-N
Synonyms
307342-68-3
(Z)3(5(1(carboxymethyl)2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5(1(carboxymethyl)2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5(1(CARBOXYMETHYL)2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3(5((3Z)1(CARBOXYMETHYL)2OXO23DIHYDRO1HINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
307342683
C1=CC=C2C(=C1)C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C(=O)N2CC(=O)O
InChI=1SC16H12N2O6S2c1910(20)561715(24)13(2616(17)25)12831249(8)18(14(12)23)711(21)22h14H57H2(H1920)(H2122)b1312
MFCD01540067
OC(=O)CCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)O)C1=O
ZINC000001811552
ZINC1811552

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Available files

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