Vitas-M small molecule compound
(5Z)-5-[5-nitro-2-(3-phenoxypropoxy)benzylidene]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK001505
SMILES S=C1S/C(=C\c2cc(ccc2OCCCOc2ccccc2)[N+](=O)[O-])/C(=O)N1c1ccccc1
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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 C25H20N2O5S2 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5S2/c28-24-23(34-25(33)26(24)19-8-3-1-4-9-19)17-18-16-20(27(29)30)12-13-22(18)32-15-7-14-31-21-10-5-2-6-11-21/h1-6,8-13,16-17H,7,14-15H2/b23-17-InChIKey
VGVPHBVAXPIWHX-QJOMJCCJSA-NSynonyms
(5Z)5((5NITRO2(3PHENOXYPROPOXY)PHENYL)METHYLIDENE)3PHENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(5NITRO2(3PHENOXYPROPOXY)BENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)(N+)(=O)(O))OCCCOC4=CC=CC=C4)SC2=S
InChI=1SC25H20N2O5S2c282423(3425(33)26(24)198314919)17181620(27(29)30)121322(18)32157143121105261121h168131617H71415H2b2317
MFCD03183739
S=C1SC(=Cc2cc(ccc2OCCCOc2ccccc2)(N+)(=O)(O))C(=O)N1c1ccccc1
STK001505
ZINC000008916032
ZINC08916032
ZINC8916032
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