Vitas-M small molecule compound
2-[(5E)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioic acid
Catalog ID
STL035745
SMILES COc1cccc(c1)/C=C\1/SC(=S)N(C1=O)C(C(=O)O)CC(=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 C15H13NO6S2 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO6S2/c1-22-9-4-2-3-8(5-9)6-11-13(19)16(15(23)24-11)10(14(20)21)7-12(17)18/h2-6,10H,7H2,1H3,(H,17,18)(H,20,21)/b11-6+InChIKey
WHECEDBSMZOBPW-IZZDOVSWSA-NSynonyms
2((5E)5((3methoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)butanedioicacid
2((5E)5(3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)butanedioicacid
COC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)C(CC(=O)O)C(=O)O
COc1cccc(c1)C=C1SC(=S)N(C1=O)C(C(=O)O)CC(=O)O
InChI=1SC15H13NO6S2c12294238(59)61113(19)16(15(23)2411)10(14(20)21)712(17)18h2610H7H21H3(H1718)(H2021)b116+
MFCD18192136
ZINC000032707967
ZINC000032707969
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