Vitas-M small molecule compound

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

Catalog ID
STK101772
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/c1ccc(s1)Br

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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 C22H17BrClN5OS2 MW 546.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrClN5OS2/c1-14-2-4-15(5-3-14)21-27-28-22(29(21)17-8-6-16(24)7-9-17)31-13-20(30)26-25-12-18-10-11-19(23)32-18/h2-12H,13H2,1H3,(H,26,30)/b25-12+
InChIKey
WAYLDPAPKLHDHC-BRJLIKDPSA-N
Synonyms
496799-63-4
(E)N((5bromothiophen2yl)methylene)2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)acetohydrazide
496799634
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC=C(S4)Br
InChI=1SC22H17BrClN5OS2c1142415(5314)21272822(29(21)178616(24)7917)311320(30)26251218101119(23)3218h212H13H21H3(H2630)b2512+
MFCD03220122
N((E)(5BROMOTHIOPHEN2YL)METHYLIDENE)2((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)(5BROMOTHIOPHEN2YL)METHYLIDENEAMINO)2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=Cc1ccc(s1)Br
ZINC000001805622
ZINC101504959

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Available files

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