Vitas-M small molecule compound

4-{(5Z)-4-oxo-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}benzoic acid

Catalog ID
STK548493
SMILES C=CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)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 C20H15NO4S2 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15NO4S2/c1-2-11-25-16-9-3-13(4-10-16)12-17-18(22)21(20(26)27-17)15-7-5-14(6-8-15)19(23)24/h2-10,12H,1,11H2,(H,23,24)/b17-12-
InChIKey
NEYQAPJQNDUXTK-ATVHPVEESA-N
Synonyms
641998-63-2
(Z)4(5(4(allyloxy)benzylidene)4oxo2thioxothiazolidin3yl)benzoicacid
4((5Z)4OXO5((4PROP2ENOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
4((5Z)4oxo5(4(prop2en1yloxy)benzylidene)2thioxo13thiazolidin3yl)benzoicacid
641998632
C=CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=C(C=C3)C(=O)O
C=CCOc1ccc(cc1)C=C1SC(=S)N(C1=O)c1ccc(cc1)C(=O)O
InChI=1SC20H15NO4S2c121125169313(41016)121718(22)21(20(26)2717)157514(6815)19(23)24h21012H111H2(H2324)b1712
MFCD03666864
ZINC000001813765
ZINC1813765

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Available files

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