Vitas-M small molecule compound

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

Catalog ID
STL057066
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)N/N=C/c1ccccc1Br

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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 C23H16BrCl2N5OS MW 561.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrCl2N5OS/c24-20-4-2-1-3-16(20)13-27-28-21(32)14-33-23-30-29-22(15-5-7-17(25)8-6-15)31(23)19-11-9-18(26)10-12-19/h1-13H,14H2,(H,28,32)/b27-13+
InChIKey
KMSXTDYKYIYVTL-UVHMKAGCSA-N
Synonyms

(E)2((45bis(4chlorophenyl)4H124triazol3yl)thio)N(2bromobenzylidene)acetohydrazide
2((45BIS(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(2BROMOPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((45bis(4chlorophenyl)4H124triazol3yl)sulfanyl)N((E)(2bromophenyl)methylidene)acetohydrazide
C1=CC=C(C(=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)Br
InChI=1SC23H16BrCl2N5OSc2420421316(20)13272821(32)143323302922(155717(25)8615)31(23)1911918(26)101219h113H14H2(H2832)b2713+
MFCD03683704
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)NN=Cc1ccccc1Br
ZINC000002605589
ZINC103128954

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Available files

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