Vitas-M small molecule compound

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

Catalog ID
STL307975
SMILES CCOc1ccc(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 C26H31N5O2S MW 477.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N5O2S/c1-3-33-23-15-11-20(12-16-23)17-27-28-24(32)18-34-26-30-29-25(21-13-9-19(2)10-14-21)31(26)22-7-5-4-6-8-22/h9-17,22H,3-8,18H2,1-2H3,(H,28,32)/b27-17+
InChIKey
MFLGNIIFJPXLJI-WPWMEQJKSA-N
Synonyms
497169-27-4
(E)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)N(4ethoxybenzylidene)acetohydrazide
2((4cyclohexyl5(4methylphenyl)124triazol3yl)sulfanyl)N((E)(4ethoxyphenyl)methylideneamino)acetamide
2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)(4ethoxyphenyl)methylidene)acetohydrazide
497169274
CCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)C
InChI=1SC26H31N5O2Sc133323151120(121623)17272824(32)183426302925(2113919(2)101421)31(26)227546822h91722H3818H212H3(H2832)b2717+
MFCD03222437
N((1E)2(4ETHOXYPHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000013659832
ZINC101422135

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Available files

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