Vitas-M small molecule compound

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

Catalog ID
STL307982
SMILES COc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-18-8-12-20(13-9-18)24-28-29-25(30(24)21-6-4-3-5-7-21)33-17-23(31)27-26-16-19-10-14-22(32-2)15-11-19/h8-16,21H,3-7,17H2,1-2H3,(H,27,31)/b26-16+
InChIKey
PXLULPGZXZXDFI-WGOQTCKBSA-N
Synonyms
497169-39-8
(E)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)N(4methoxybenzylidene)acetohydrazide
2((4cyclohexyl5(4methylphenyl)124triazol3yl)sulfanyl)N((E)(4methoxyphenyl)methylideneamino)acetamide
2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)(4methoxyphenyl)methylidene)acetohydrazide
497169398
CC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)NN=CC4=CC=C(C=C4)OC
InChI=1SC25H29N5O2Sc11881220(13918)24282925(30(24)216435721)331723(31)27261619101422(322)151119h81621H3717H212H3(H2731)b2616+
MFCD03222455
N((1E)2(4METHOXYPHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009428343
ZINC101422126

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Available files

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