Vitas-M small molecule compound

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

Catalog ID
STK001234
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)N/N=C/c1cccn1C

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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 C22H25ClN6OS MW 457.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN6OS/c1-28-13-5-8-19(28)14-24-25-20(30)15-31-22-27-26-21(16-9-11-17(23)12-10-16)29(22)18-6-3-2-4-7-18/h5,8-14,18H,2-4,6-7,15H2,1H3,(H,25,30)/b24-14+
InChIKey
OKVZMIQFFVJAIT-ZVHZXABRSA-N
Synonyms
488854-41-7
(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N((1methyl1Hpyrrol2yl)methylene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(1methylpyrrol2yl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(1METHYL1HPYRROL2YL)METHYLIDENE)ACETOHYDRAZIDE
488854417
CN1C=CC=C1C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Cl
InChI=1SC22H25ClN6OSc128135819(28)14242520(30)153122272621(1691117(23)121016)29(22)186324718h581418H246715H21H3(H2530)b2414+
MFCD03221011
N((1E)2(1METHYLPYRROL2YL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)NN=Cc1cccn1C
STK001234
ZINC000001305406
ZINC33334680

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Available files

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