Vitas-M small molecule compound

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

Catalog ID
STK110757
SMILES CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(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 C25H21ClN6O4S MW 537.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN6O4S/c1-2-36-22-13-11-20(12-14-22)31-24(18-5-7-19(26)8-6-18)29-30-25(31)37-16-23(33)28-27-15-17-3-9-21(10-4-17)32(34)35/h3-15H,2,16H2,1H3,(H,28,33)/b27-15+
InChIKey
ULYMWMCMKUKWHR-JFLMPSFJSA-N
Synonyms
488709-63-3
(E)2((5(4chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)thio)N(4nitrobenzylidene)acetohydrazide
2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4NITROPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(4NITROPHENYL)METHYLIDENE)ACETOHYDRAZIDE
488709633
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=C(C=C4)Cl
CCOc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2)(N+)(=O)(O))nnc1c1ccc(cc1)Cl
InChI=1SC25H21ClN6O4Sc123622131120(121422)3124(185719(26)8618)293025(31)371623(33)282715173921(10417)32(34)35h315H216H21H3(H2833)b2715+
MFCD01586330
N((1E)2(4NITROPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4(4ETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001815130
ZINC100242287

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Available files

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