Vitas-M small molecule compound
methyl 5-[(2-methoxy-4-{(E)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]furan-2-carboxylate
Catalog ID
STK398342
SMILES C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OCc2ccc(o2)C(=O)OC)/C1=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 C21H19NO6S2 MW 445.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO6S2/c1-4-9-22-19(23)18(30-21(22)29)11-13-5-7-15(17(10-13)25-2)27-12-14-6-8-16(28-14)20(24)26-3/h4-8,10-11H,1,9,12H2,2-3H3/b18-11+InChIKey
YYGCSKXCTPAFQQ-WOJGMQOQSA-NSynonyms
C=CCN1C(=S)SC(=Cc2ccc(c(c2)OC)OCc2ccc(o2)C(=O)OC)C1=O
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC=C)OCC3=CC=C(O3)C(=O)OC
InChI=1SC21H19NO6S2c1492219(23)18(3021(22)29)11135715(17(1013)252)2712146816(2814)20(24)263h481011H1912H223H3b1811+
METHYL5((2METHOXY4((E)(4OXO3(PROP2EN1YL)2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)FURAN2CARBOXYLATE
methyl5((2methoxy4((E)(4oxo3prop2enyl2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)methyl)furan2carboxylate
MFCD05816338
ZINC000009972926
ZINC09972926
ZINC9972926
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