Vitas-M small molecule compound
3-[(5E)-5-(4-ethoxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid
Catalog ID
STK699321
SMILES CCOc1ccc(cc1OC)/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 C20H17NO5S2 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5S2/c1-3-26-15-8-7-12(9-16(15)25-2)10-17-18(22)21(20(27)28-17)14-6-4-5-13(11-14)19(23)24/h4-11H,3H2,1-2H3,(H,23,24)/b17-10+InChIKey
BLQQRKKLLRQFHD-LICLKQGHSA-NSynonyms
(Z)3(5(4ethoxy3methoxybenzylidene)4oxo2thioxothiazolidin3yl)benzoicacid
3((5E)5((4ETHOXY3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
3((5E)5(4ethoxy3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)benzoicacid
CCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O)OC
CCOc1ccc(cc1OC)C=C1SC(=S)N(C1=O)c1cccc(c1)C(=O)O
InChI=1SC20H17NO5S2c1326158712(916(15)252)101718(22)21(20(27)2817)1464513(1114)19(23)24h411H3H212H3(H2324)b1710+
MFCD13371088
ZINC000001248754
ZINC1248754
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