Vitas-M small molecule compound
4-[(E)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate
Catalog ID
STK809198
SMILES CCCCN1C(=S)S/C(=C/c2ccc(cc2)OC(=O)c2ccc(cc2)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 C22H21NO4S2 MW 427.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO4S2/c1-3-4-13-23-20(24)19(29-22(23)28)14-15-5-9-18(10-6-15)27-21(25)16-7-11-17(26-2)12-8-16/h5-12,14H,3-4,13H2,1-2H3/b19-14+InChIKey
QNULAPHWXKJEPY-XMHGGMMESA-NSynonyms
(4((E)(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)4METHOXYBENZOATE
4((E)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl4methoxybenzoate
CCCCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OC)SC1=S
CCCCN1C(=S)SC(=Cc2ccc(cc2)OC(=O)c2ccc(cc2)OC)C1=O
InChI=1SC22H21NO4S2c134132320(24)19(2922(23)28)14155918(10615)2721(25)1671117(262)12816h51214H3413H212H3b1914+
MFCD03461257
ZINC000016790614
ZINC16790614
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