Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL332878
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2ccc(cc2)Cl)cc(c1OC)OC
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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 C21H22ClN5O4S MW 475.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O4S/c1-27-20(14-5-7-15(22)8-6-14)25-26-21(27)32-12-18(28)24-23-11-13-9-16(29-2)19(31-4)17(10-13)30-3/h5-11H,12H2,1-4H3,(H,24,28)/b23-11+InChIKey
MGURWVUHFJQBJB-FOKLQQMPSA-NSynonyms
347910-52-5(E)2((5(4chlorophenyl)4methyl4H124triazol3yl)thio)N(345trimethoxybenzylidene)acetohydrazide
2((5(4CHLOROPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N((E)(345TRIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4chlorophenyl)4methyl4H124triazol3yl)sulfanyl)N((E)(345trimethoxyphenyl)methylidene)acetohydrazide
347910525
CN1C(=NN=C1SCC(=O)NN=CC2=CC(=C(C(=C2)OC)OC)OC)C3=CC=C(C=C3)Cl
COc1cc(C=NNC(=O)CSc2nnc(n2C)c2ccc(cc2)Cl)cc(c1OC)OC
InChI=1SC21H22ClN5O4Sc12720(145715(22)8614)252621(27)321218(28)24231113916(292)19(314)17(1013)303h511H12H214H3(H2428)b2311+
MFCD02609989
ZINC000002316778
ZINC33352848
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