Vitas-M small molecule compound
(5E)-3-ethyl-5-[5-nitro-2-(2-phenoxyethoxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK024608
SMILES CCN1C(=S)S/C(=C/c2cc(ccc2OCCOc2ccccc2)[N+](=O)[O-])/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 C20H18N2O5S2 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S2/c1-2-21-19(23)18(29-20(21)28)13-14-12-15(22(24)25)8-9-17(14)27-11-10-26-16-6-4-3-5-7-16/h3-9,12-13H,2,10-11H2,1H3/b18-13+InChIKey
YRGPCTXCPBZJFZ-QGOAFFKASA-NSynonyms
(5E)3ETHYL5((5NITRO2(2PHENOXYETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)3ETHYL5(5NITRO2(2PHENOXYETHOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=C(C=CC(=C2)(N+)(=O)(O))OCCOC3=CC=CC=C3)SC1=S
CCN1C(=S)SC(=Cc2cc(ccc2OCCOc2ccccc2)(N+)(=O)(O))C1=O
InChI=1SC20H18N2O5S2c122119(23)18(2920(21)28)13141215(22(24)25)8917(14)27111026166435716h391213H21011H21H3b1813+
MFCD02120816
STK024608
ZINC000013940571
ZINC13940571
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