Vitas-M small molecule compound

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

Catalog ID
STK080462
SMILES COc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

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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 C25H22ClN5O2S MW 492.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O2S/c1-17-3-11-21(12-4-17)31-24(19-7-9-20(26)10-8-19)29-30-25(31)34-16-23(32)28-27-15-18-5-13-22(33-2)14-6-18/h3-15H,16H2,1-2H3,(H,28,32)/b27-15+
InChIKey
JAOLOASDRJTANF-JFLMPSFJSA-N
Synonyms
315231-43-7
(E)2((5(4chlorophenyl)4(ptolyl)4H124triazol3yl)thio)N(4methoxybenzylidene)acetohydrazide
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4METHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(4METHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
315231437
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl
COc1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl
InChI=1SC25H22ClN5O2Sc11731121(12417)3124(197920(26)10819)293025(31)341623(32)2827151851322(332)14618h315H16H212H3(H2832)b2715+
MFCD02077451
N((1E)2(4METHOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
STK080462
ZINC000001813927
ZINC33344867

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Available files

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