Vitas-M small molecule compound
(2-methoxy-4-{(Z)-[4-oxo-3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STL406229
SMILES COc1cc(ccc1OCC(=O)O)/C=C/1\SC(=S)N(C1=O)Cc1cccnc1
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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 C19H16N2O5S2 MW 416.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5S2/c1-25-15-7-12(4-5-14(15)26-11-17(22)23)8-16-18(24)21(19(27)28-16)10-13-3-2-6-20-9-13/h2-9H,10-11H2,1H3,(H,22,23)/b16-8-InChIKey
VYKHXNBLTLHVSM-PXNMLYILSA-NSynonyms
(2methoxy4((Z)(4oxo3(pyridin3ylmethyl)2thioxo13thiazolidin5ylidene)methyl)phenoxy)aceticacid
2(2methoxy4((Z)(4oxo3(pyridin3ylmethyl)2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)aceticacid
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CN=CC=C3)OCC(=O)O
COc1cc(ccc1OCC(=O)O)C=C1SC(=S)N(C1=O)Cc1cccnc1
InChI=1SC19H16N2O5S2c12515712(4514(15)261117(22)23)81618(24)21(19(27)2816)101332620913h29H1011H21H3(H2223)b168
MFCD30704430
ZINC000223208211
ZINC223208211
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