Vitas-M small molecule compound
4-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-methyl-1-benzofuran-2-carboxylate
Catalog ID
STK703251
SMILES CCN1C(=S)S/C(=C\c2ccc(cc2)OC(=O)c2oc3c(c2C)cccc3)/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 C22H17NO4S2 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO4S2/c1-3-23-20(24)18(29-22(23)28)12-14-8-10-15(11-9-14)26-21(25)19-13(2)16-6-4-5-7-17(16)27-19/h4-12H,3H2,1-2H3/b18-12-InChIKey
SWWFRDMIQMINGI-PDGQHHTCSA-NSynonyms
(4((Z)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)3METHYL1BENZOFURAN2CARBOXYLATE
(E)4((3ethyl4oxo2thioxothiazolidin5ylidene)methyl)phenyl3methylbenzofuran2carboxylate
4((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl3methyl1benzofuran2carboxylate
CCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=C(C4=CC=CC=C4O3)C)SC1=S
CCN1C(=S)SC(=Cc2ccc(cc2)OC(=O)c2oc3c(c2C)cccc3)C1=O
InChI=1SC22H17NO4S2c132320(24)18(2922(23)28)121481015(11914)2621(25)1913(2)16645717(16)2719h412H3H212H3b1812
MFCD04445753
ZINC000001103706
ZINC01103706
ZINC1103706
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