Vitas-M small molecule compound

N'-[(E)-biphenyl-4-ylmethylidene]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STL362520
SMILES CCn1c(SCC(=O)N/N=C/c2ccc(cc2)c2ccccc2)nnc1c1ccc(cc1)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 C26H25N5O2S MW 471.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O2S/c1-3-31-25(22-13-15-23(33-2)16-14-22)29-30-26(31)34-18-24(32)28-27-17-19-9-11-21(12-10-19)20-7-5-4-6-8-20/h4-17H,3,18H2,1-2H3,(H,28,32)/b27-17+
InChIKey
MRXXDQOIPDGHSN-WPWMEQJKSA-N
Synonyms
303102-60-5
(E)N((11biphenyl)4ylmethylene)2((4ethyl5(4methoxyphenyl)4H124triazol3yl)thio)acetohydrazide
2((4ETHYL5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4PHENYLPHENYL)METHYLIDENEAMINO)ACETAMIDE
303102605
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OC
CCn1c(SCC(=O)NN=Cc2ccc(cc2)c2ccccc2)nnc1c1ccc(cc1)OC
InChI=1SC26H25N5O2Sc133125(22131523(332)161422)293026(31)341824(32)2827171991121(121019)207546820h417H318H212H3(H2832)b2717+
MFCD02675500
N((1E)2(4PHENYLPHENYL)1AZAVINYL)2(4ETHYL5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)biphenyl4ylmethylidene)2((4ethyl5(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetohydrazide
ZINC000002340031
ZINC33361867

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Available files

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