Vitas-M small molecule compound
2-ethoxy-4-[(E)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzoate
Catalog ID
STK094371
SMILES CCOc1cc(ccc1OC(=O)c1ccccc1)/C=C\1/SC(=S)N(C1=O)CC
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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 C21H19NO4S2 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO4S2/c1-3-22-19(23)18(28-21(22)27)13-14-10-11-16(17(12-14)25-4-2)26-20(24)15-8-6-5-7-9-15/h5-13H,3-4H2,1-2H3/b18-13+InChIKey
NDVWJUBUNCJFHX-QGOAFFKASA-NSynonyms
(2ETHOXY4((E)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)BENZOATE
2ETHOXY4((E)(3ETHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYLBENZOATE
CCN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OCC)SC1=S
CCOc1cc(ccc1OC(=O)c1ccccc1)C=C1SC(=S)N(C1=O)CC
InChI=1SC21H19NO4S2c132219(23)18(2821(22)27)1314101116(17(1214)2542)2620(24)158657915h513H34H212H3b1813+
MFCD01207290
STK094371
ZINC000004675672
ZINC04675672
ZINC4675672
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