Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}acetohydrazide

Catalog ID
STK102971
SMILES CSc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1CC)c1ccc(cc1)C(C)(C)C

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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 C24H29N5OS2 MW 467.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5OS2/c1-6-29-22(18-9-11-19(12-10-18)24(2,3)4)27-28-23(29)32-16-21(30)26-25-15-17-7-13-20(31-5)14-8-17/h7-15H,6,16H2,1-5H3,(H,26,30)/b25-15+
InChIKey
LUVDRKAQLQXEQL-MFKUBSTISA-N
Synonyms
487029-93-6
(E)2((5(4(tertbutyl)phenyl)4ethyl4H124triazol3yl)thio)N(4(methylthio)benzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((E)(4METHYLSULFANYLPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N((E)(4(METHYLSULFANYL)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
487029936
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=C(C=C2)SC)C3=CC=C(C=C3)C(C)(C)C
CSc1ccc(cc1)C=NNC(=O)CSc1nnc(n1CC)c1ccc(cc1)C(C)(C)C
InChI=1SC24H29N5OS2c162922(1891119(121018)24(23)4)272823(29)321621(30)2625151771320(315)14817h715H616H215H3(H2630)b2515+
MFCD03219155
N((1E)2(4METHYLTHIOPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001840941
ZINC33345351

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.