Vitas-M small molecule compound
N-[(5E)-5-{4-[(2-cyanobenzyl)oxy]-3-ethoxybenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Catalog ID
STK284527
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)/C=C\1/SC(=S)N(C1=O)NC(=O)c1ccccc1
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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 C27H21N3O4S2 MW 515.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4S2/c1-2-33-23-14-18(12-13-22(23)34-17-21-11-7-6-10-20(21)16-28)15-24-26(32)30(27(35)36-24)29-25(31)19-8-4-3-5-9-19/h3-15H,2,17H2,1H3,(H,29,31)/b24-15+InChIKey
SQXFGFXGYTUPFJ-BUVRLJJBSA-NSynonyms
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3)OCC4=CC=CC=C4C#N
CCOc1cc(ccc1OCc1ccccc1C#N)C=C1SC(=S)N(C1=O)NC(=O)c1ccccc1
InChI=1SC27H21N3O4S2c1233231418(121322(23)34172111761020(21)1628)152426(32)30(27(35)3624)2925(31)198435919h315H217H21H3(H2931)b2415+
MFCD04084477
N((5E)5((4((2cyanophenyl)methoxy)3ethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)benzamide
N((5E)5(4((2CYANOBENZYL)OXY)3ETHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZAMIDE
ZINC000009187013
ZINC09187013
ZINC9187013
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