Vitas-M small molecule compound
{(5E)-5-[3-fluoro-4-(pyrrolidin-1-yl)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK155248
SMILES OC(=O)CN1C(=S)S/C(=C/c2ccc(c(c2)F)N2CCCC2)/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 C16H15FN2O3S2 MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN2O3S2/c17-11-7-10(3-4-12(11)18-5-1-2-6-18)8-13-15(22)19(9-14(20)21)16(23)24-13/h3-4,7-8H,1-2,5-6,9H2,(H,20,21)/b13-8+InChIKey
CVPLUAOCXVDQHH-MDWZMJQESA-NSynonyms
((5E)5(3FLUORO4(PYRROLIDIN1YL)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5((3FLUORO4PYRROLIDIN1YLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
C1CCN(C1)C2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O)F
InChI=1SC16H15FN2O3S2c1711710(3412(11)18512618)81315(22)19(914(20)21)16(23)2413h3478H12569H2(H2021)b138+
MFCD03721574
OC(=O)CN1C(=S)SC(=Cc2ccc(c(c2)F)N2CCCC2)C1=O
ZINC000002830304
ZINC2830304
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