Vitas-M small molecule compound
propan-2-yl [(5Z)-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STL375420
SMILES CC(OC(=O)CN1C(=O)S/C(=C\c2ccc(cc2)Oc2ccc(cn2)[N+](=O)[O-])/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 C20H17N3O7S MW 443.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O7S/c1-12(2)29-18(24)11-22-19(25)16(31-20(22)26)9-13-3-6-15(7-4-13)30-17-8-5-14(10-21-17)23(27)28/h3-10,12H,11H2,1-2H3/b16-9-InChIKey
TVQKATGPEHKALZ-SXGWCWSVSA-NSynonyms
CC(C)OC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)OC3=NC=C(C=C3)(N+)(=O)(O))SC1=O
CC(OC(=O)CN1C(=O)SC(=Cc2ccc(cc2)Oc2ccc(cn2)(N+)(=O)(O))C1=O)C
InChI=1SC20H17N3O7Sc112(2)2918(24)112219(25)16(3120(22)26)9133615(7413)30178514(102117)23(27)28h31012H11H212H3b169
MFCD28951115
propan2yl((5Z)5(4((5nitropyridin2yl)oxy)benzylidene)24dioxo13thiazolidin3yl)acetate
propan2yl2((5Z)5((4(5nitropyridin2yl)oxyphenyl)methylidene)24dioxo13thiazolidin3yl)acetate
ZINC000096569957
ZINC96569957
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