Vitas-M small molecule compound

3-{(5Z)-5-[3-(benzyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid

Catalog ID
STK795187
SMILES OC(=O)CCN1C(=S)S/C(=C\c2cccc(c2)OCc2ccccc2)/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 C20H17NO4S2 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO4S2/c22-18(23)9-10-21-19(24)17(27-20(21)26)12-15-7-4-8-16(11-15)25-13-14-5-2-1-3-6-14/h1-8,11-12H,9-10,13H2,(H,22,23)/b17-12-
InChIKey
XRUZQMALKZLVGA-ATVHPVEESA-N
Synonyms

(Z)3(5(3(benzyloxy)benzylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)4oxo5((3phenylmethoxyphenyl)methylidene)2sulfanylidene13thiazolidin3yl)propanoicacid
3((5Z)5(3(benzyloxy)benzylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3(4OXO5((3(PHENYLMETHOXY)PHENYL)METHYLENE)2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
3(5(3BENZYLOXYBENZYLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)PROPIONICACID
C1=CC=C(C=C1)COC2=CC=CC(=C2)C=C3C(=O)N(C(=S)S3)CCC(=O)O
InChI=1SC20H17NO4S2c2218(23)9102119(24)17(2720(21)26)121574816(1115)2513145213614h181112H91013H2(H2223)b1712
MFCD02165875
OC(=O)CCN1C(=S)SC(=Cc2cccc(c2)OCc2ccccc2)C1=O
ZINC000000967017
ZINC967017

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Available files

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