Vitas-M small molecule compound

2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}acetohydrazide

Catalog ID
STK072864
SMILES CCN(c1ccc(c(c1)O)/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1)CC

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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 C27H27ClN6O2S MW 535.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN6O2S/c1-3-33(4-2)23-13-10-20(24(35)16-23)17-29-30-25(36)18-37-27-32-31-26(19-8-6-5-7-9-19)34(27)22-14-11-21(28)12-15-22/h5-17,35H,3-4,18H2,1-2H3,(H,30,36)/b29-17+
InChIKey
LBZSQSPGXAUBFZ-STBIYBPSSA-N
Synonyms
315199-79-2
(E)2((4(4chlorophenyl)5phenyl4H124triazol3yl)thio)N(4(diethylamino)2hydroxybenzylidene)acetohydrazide
2((4(4chlorophenyl)5phenyl4H124triazol3yl)sulfanyl)N((E)(4(diethylamino)2hydroxyphenyl)methylidene)acetohydrazide
2((E)((2((4(4chlorophenyl)5phenyl124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)5(diethylazaniumyl)phenolate
2((E)(2(((4(4CHLOROPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)5(DIETHYLAMMONIO)PHENOLATE
CC(NH+)(CC)C1=CC(=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)(O)
CCN(c1ccc(c(c1)O)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1)CC
InChI=1SC27H27ClN6O2Sc1333(42)23131020(24(35)1623)17293025(36)183727323126(198657919)34(27)22141121(28)121522h51735H3418H212H3(H3036)b2917+
STK072864
ZINC000001867787

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Available files

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