Vitas-M small molecule compound

2-{(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid

Catalog ID
STK551947
SMILES CCC(N1C(=S)S/C(=C\C(=C\c2ccccc2)\C)/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 C17H17NO3S2 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S2/c1-3-13(16(20)21)18-15(19)14(23-17(18)22)10-11(2)9-12-7-5-4-6-8-12/h4-10,13H,3H2,1-2H3,(H,20,21)/b11-9+,14-10-
InChIKey
KJENGCMUGBOVLB-VDVFTDKOSA-N
Synonyms

2((5Z)4KETO5((E)2METHYL3PHENYLPROP2ENYLIDENE)2THIOXOTHIAZOLIDIN3YL)BUTYRICACID
2((5Z)5((2E)2methyl3phenylprop2en1ylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
2((5Z)5((E)2METHYL3PHENYLPROP2ENYLIDENE)4OXIDANYLIDENE2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
2((5Z)5((E)2METHYL3PHENYLPROP2ENYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
2((5Z)5((E)2METHYL3PHENYLPROP2ENYLIDENE)4OXO2SULFANYLIDENE3THIAZOLIDINYL)BUTANOICACID
2((Z)5((E)2methyl3phenylallylidene)4oxo2thioxothiazolidin3yl)butanoicacid
2(5((E)2METHYL3PHENYLPROP2EN(Z)YLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)BUTYRICACID
CCC(C(=O)O)N1C(=O)C(=CC(=CC2=CC=CC=C2)C)SC1=S
CCC(N1C(=S)SC(=CC(=Cc2ccccc2)C)C1=O)C(=O)O
InChI=1SC17H17NO3S2c1313(16(20)21)1815(19)14(2317(18)22)1011(2)9127546812h41013H3H212H3(H2021)b119+1410
MFCD03676448
ZINC000001791194
ZINC000005024824

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Available files

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