Vitas-M small molecule compound
3-[(5E)-4-oxo-5-(2-propoxybenzylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid
Catalog ID
STK116262
SMILES CCCOc1ccccc1/C=C\1/SC(=S)N(C1=O)c1cccc(c1)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 C20H17NO4S2 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO4S2/c1-2-10-25-16-9-4-3-6-13(16)12-17-18(22)21(20(26)27-17)15-8-5-7-14(11-15)19(23)24/h3-9,11-12H,2,10H2,1H3,(H,23,24)/b17-12+InChIKey
XGYMFGPWWSGXAB-SFQUDFHCSA-NSynonyms
591734-94-03((5E)4OXO5((2PROPOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
3((5E)4OXO5(2PROPOXYBENZYLIDENE)2THIOXO13THIAZOLIDIN3YL)BENZOICACID
591734940
CCCOC1=CC=CC=C1C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O
CCCOc1ccccc1C=C1SC(=S)N(C1=O)c1cccc(c1)C(=O)O
InChI=1SC20H17NO4S2c12102516943613(16)121718(22)21(20(26)2717)1585714(1115)19(23)24h391112H210H21H3(H2324)b1712+
MFCD04084703
ZINC000004690753
ZINC4690753
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