Vitas-M small molecule compound

N-(4-{5-[(2-cyanobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}phenyl)benzamide

Catalog ID
STK154261
SMILES N#Cc1ccccc1CSc1nnc(n1CC)c1ccc(cc1)NC(=O)c1ccccc1

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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 C25H21N5OS MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5OS/c1-2-30-23(28-29-25(30)32-17-21-11-7-6-10-20(21)16-26)18-12-14-22(15-13-18)27-24(31)19-8-4-3-5-9-19/h3-15H,2,17H2,1H3,(H,27,31)
InChIKey
MVXPHNJQNFKJDJ-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4
InChI=1SC25H21N5OSc123023(282925(30)32172111761020(21)1626)18121422(151318)2724(31)198435919h315H217H21H3(H2731)
MFCD03877904
N(4(5((2CYANOBENZYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)PHENYL)BENZAMIDE
N(4(5((2CYANOPHENYL)METHYLSULFANYL)4ETHYL124TRIAZOL3YL)PHENYL)BENZAMIDE
ZINC000013881275
ZINC13881275

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Available files

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