Vitas-M small molecule compound
2-ethoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-methyl-1-benzofuran-2-carboxylate
Catalog ID
STK600079
SMILES CCOc1cc(ccc1OC(=O)c1oc2c(c1C)cccc2)/C=C\1/SC(=S)N(C1=O)C
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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 C23H19NO5S2 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19NO5S2/c1-4-27-18-11-14(12-19-21(25)24(3)23(30)31-19)9-10-17(18)29-22(26)20-13(2)15-7-5-6-8-16(15)28-20/h5-12H,4H2,1-3H3/b19-12+InChIKey
IKYXPUNBUBWVCY-XDHOZWIPSA-NSynonyms
381189-79-3(2ETHOXY4((E)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)3METHYL1BENZOFURAN2CARBOXYLATE
(E)2ethoxy4((3methyl4oxo2thioxothiazolidin5ylidene)methyl)phenyl3methylbenzofuran2carboxylate
2ethoxy4((E)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl3methyl1benzofuran2carboxylate
381189793
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C)OC(=O)C3=C(C4=CC=CC=C4O3)C
CCOc1cc(ccc1OC(=O)c1oc2c(c1C)cccc2)C=C1SC(=S)N(C1=O)C
InChI=1SC23H19NO5S2c1427181114(121921(25)24(3)23(30)3119)91017(18)2922(26)2013(2)15756816(15)2820h512H4H213H3b1912+
MFCD02993703
ZINC000013815471
ZINC13815471
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