Vitas-M small molecule compound
ethyl 4-{5-[(E)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STK742302
SMILES CCCN1C(=S)S/C(=C/c2ccc(o2)c2ccc(cc2)C(=O)OCC)/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 C20H19NO4S2 MW 401.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4S2/c1-3-11-21-18(22)17(27-20(21)26)12-15-9-10-16(25-15)13-5-7-14(8-6-13)19(23)24-4-2/h5-10,12H,3-4,11H2,1-2H3/b17-12+InChIKey
KDALUOVPLRUSCO-SFQUDFHCSA-NSynonyms
CCCN1C(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)OCC)SC1=S
CCCN1C(=S)SC(=Cc2ccc(o2)c2ccc(cc2)C(=O)OCC)C1=O
ETHYL4(5((E)(4OXO3PROPYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)BENZOATE
ethyl4(5((E)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)furan2yl)benzoate
InChI=1SC20H19NO4S2c13112118(22)17(2720(21)26)121591016(2515)135714(8613)19(23)2442h51012H3411H212H3b1712+
MFCD01591208
ZINC000005058974
ZINC05058974
ZINC5058974
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