Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide

Catalog ID
STK021492
SMILES COc1cc(OC)cc(c1/C=N/NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)OC

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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 C26H30ClN5O4S MW 544.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30ClN5O4S/c1-34-20-13-22(35-2)21(23(14-20)36-3)15-28-29-24(33)16-37-26-31-30-25(17-9-11-18(27)12-10-17)32(26)19-7-5-4-6-8-19/h9-15,19H,4-8,16H2,1-3H3,(H,29,33)/b28-15+
InChIKey
YGKKZNHZHPKJNU-RWPZCVJISA-N
Synonyms
488089-37-8
(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(246trimethoxybenzylidene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(246trimethoxyphenyl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(246TRIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
488089378
COC1=CC(=C(C(=C1)OC)C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Cl)OC
COc1cc(OC)cc(c1C=NNC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)OC
InChI=1SC26H30ClN5O4Sc134201322(352)21(23(1420)363)15282924(33)163726313025(1791118(27)121017)32(26)197546819h91519H4816H213H3(H2933)b2815+
MFCD03220971
N((1E)2(246TRIMETHOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK021492
ZINC000100832932
ZINC101404416

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Available files

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