Vitas-M small molecule compound
2-chloro-N-{(5Z)-5-[4-(cyanomethoxy)-3-methoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-4-methylbenzamide
Catalog ID
STK195635
SMILES N#CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1Cl)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 C21H16ClN3O4S2 MW 473.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O4S2/c1-12-3-5-14(15(22)9-12)19(26)24-25-20(27)18(31-21(25)30)11-13-4-6-16(29-8-7-23)17(10-13)28-2/h3-6,9-11H,8H2,1-2H3,(H,24,26)/b18-11-InChIKey
OMGRYTDOPFTCQB-WQRHYEAKSA-NSynonyms
2chloroN((5Z)5((4(cyanomethoxy)3methoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)4methylbenzamide
2CHLORON((5Z)5(4(CYANOMETHOXY)3METHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)4METHYLBENZAMIDE
CC1=CC(=C(C=C1)C(=O)NN2C(=O)C(=CC3=CC(=C(C=C3)OCC#N)OC)SC2=S)Cl
InChI=1SC21H16ClN3O4S2c1123514(15(22)912)19(26)242520(27)18(3121(25)30)11134616(298723)17(1013)282h36911H8H212H3(H2426)b1811
MFCD04309870
N#CCOc1ccc(cc1OC)C=C1SC(=S)N(C1=O)NC(=O)c1ccc(cc1Cl)C
ZINC000012363404
ZINC12363404
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