Vitas-M small molecule compound

3-[(5Z)-4-oxo-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Catalog ID
STL363695
SMILES OC(=O)CCN1C(=S)S/C(=C\c2cccc(c2)Oc2ccccc2)/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 C19H15NO4S2 MW 385.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15NO4S2/c21-17(22)9-10-20-18(23)16(26-19(20)25)12-13-5-4-8-15(11-13)24-14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H,21,22)/b16-12-
InChIKey
MOQGNPLRXWWHSS-VBKFSLOCSA-N
Synonyms

(E)3(4oxo5(3phenoxybenzylidene)2thioxothiazolidin3yl)propanoicacid
3((5Z)4OXO5((3PHENOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5Z)4oxo5(3phenoxybenzylidene)2thioxo13thiazolidin3yl)propanoicacid
C1=CC=C(C=C1)OC2=CC=CC(=C2)C=C3C(=O)N(C(=S)S3)CCC(=O)O
InChI=1SC19H15NO4S2c2117(22)9102018(23)16(2619(20)25)121354815(1113)24146213714h181112H910H2(H2122)b1612
MFCD09537355
OC(=O)CCN1C(=S)SC(=Cc2cccc(c2)Oc2ccccc2)C1=O
ZINC000002302634
ZINC2302634

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Available files

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