Vitas-M small molecule compound
(5Z)-5-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK029166
SMILES COc1cc(ccc1OCCOc1ccc(cc1)[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)C
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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 C20H18N2O6S2 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O6S2/c1-21-19(23)18(30-20(21)29)12-13-3-8-16(17(11-13)26-2)28-10-9-27-15-6-4-14(5-7-15)22(24)25/h3-8,11-12H,9-10H2,1-2H3/b18-12-InChIKey
SUHQDLTVOCIPEA-PDGQHHTCSA-NSynonyms
(5Z)5((3METHOXY4(2(4NITROPHENOXY)ETHOXY)PHENYL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3METHOXY4(2(4NITROPHENOXY)ETHOXY)BENZYLIDENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
CN1C(=O)C(=CC2=CC(=C(C=C2)OCCOC3=CC=C(C=C3)(N+)(=O)(O))OC)SC1=S
COc1cc(ccc1OCCOc1ccc(cc1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)C
InChI=1SC20H18N2O6S2c12119(23)18(3020(21)29)12133816(17(1113)262)2810927156414(5715)22(24)25h381112H910H212H3b1812
MFCD03227703
STK029166
ZINC000002967090
ZINC02967090
ZINC2967090
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