Vitas-M small molecule compound

2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(pyridin-3-yl)ethylidene]acetohydrazide

Catalog ID
STK056701
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N/N=C(/c1cccnc1)\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 C24H22N6O2S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O2S/c1-17(19-7-6-14-25-15-19)26-27-22(31)16-33-24-29-28-23(18-10-12-21(32-2)13-11-18)30(24)20-8-4-3-5-9-20/h3-15H,16H2,1-2H3,(H,27,31)/b26-17+
InChIKey
FDNAGDPSHDSNIV-YZSQISJMSA-N
Synonyms
304449-80-7
(E)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)thio)N(1(pyridin3yl)ethylidene)acetohydrazide
2((5(4methoxyphenyl)4phenyl124triazol3yl)sulfanyl)N((E)1pyridin3ylethylideneamino)acetamide
2((5(4METHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((1E)1(PYRIDIN3YL)ETHYLIDENE)ACETOHYDRAZIDE
304449807
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)OC)C4=CN=CC=C4
COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)NN=C(c1cccnc1)C
InChI=1SC24H22N6O2Sc117(197614251519)262722(31)163324292823(18101221(322)131118)30(24)208435920h315H16H212H3(H2731)b2617+
MFCD02077307
N((1E)2(3PYRIDYL)1AZAPROP1ENYL)2(5(4METHOXYPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK056701
ZINC000004527563
ZINC00863863
ZINC863863

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Available files

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