Vitas-M small molecule compound
methyl 2-{(5E)-2,4-dioxo-5-[4-(phenylsulfanyl)benzylidene]-1,3-thiazolidin-3-yl}propanoate
Catalog ID
STK155159
SMILES COC(=O)C(N1C(=O)S/C(=C/c2ccc(cc2)Sc2ccccc2)/C1=O)C
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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/c1-13(19(23)25-2)21-18(22)17(27-20(21)24)12-14-8-10-16(11-9-14)26-15-6-4-3-5-7-15/h3-13H,1-2H3/b17-12+InChIKey
ATIVJPQMASKGJP-SFQUDFHCSA-NSynonyms
CC(C(=O)OC)N1C(=O)C(=CC2=CC=C(C=C2)SC3=CC=CC=C3)SC1=O
COC(=O)C(N1C(=O)SC(=Cc2ccc(cc2)Sc2ccccc2)C1=O)C
InChI=1SC20H17NO4S2c113(19(23)252)2118(22)17(2720(21)24)121481016(11914)26156435715h313H12H3b1712+
METHYL2((5E)24DIOXO5((4PHENYLSULFANYLPHENYL)METHYLIDENE)13THIAZOLIDIN3YL)PROPANOATE
METHYL2((5E)24DIOXO5(4(PHENYLSULFANYL)BENZYLIDENE)13THIAZOLIDIN3YL)PROPANOATE
MFCD03923104
ZINC000004695193
ZINC000004695196
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