Vitas-M small molecule compound
4-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2,6-dimethoxyphenyl acetate
Catalog ID
STK102030
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2ccc(cc2)OC)cc(c1OC(=O)C)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 C28H26ClN5O6S MW 596.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN5O6S/c1-17(35)40-26-23(38-3)13-18(14-24(26)39-4)15-30-31-25(36)16-41-28-33-32-27(19-5-11-22(37-2)12-6-19)34(28)21-9-7-20(29)8-10-21/h5-15H,16H2,1-4H3,(H,31,36)/b30-15+InChIKey
RIWBMFKITOHORC-FJEPWZHXSA-NSynonyms
(4((E)((2((4(4chlorophenyl)5(4methoxyphenyl)124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)26dimethoxyphenyl)acetate
(E)4((2(2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)acetyl)hydrazono)methyl)26dimethoxyphenylacetate
4((1E)2(2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)26DIMETHOXYPHENYLACETATE
4((E)(2(((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)26DIMETHOXYPHENYLACETATE
CC(=O)OC1=C(C=C(C=C1OC)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC)OC
COc1cc(C=NNC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2ccc(cc2)OC)cc(c1OC(=O)C)OC
InChI=1SC28H26ClN5O6Sc117(35)402623(383)1318(1424(26)394)15303125(36)164128333227(1951122(372)12619)34(28)219720(29)81021h515H16H214H3(H3136)b3015+
MFCD03220569
ZINC000100851916
ZINC101505209
Check stock
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Check stock on Vitas-MAvailable files
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