Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[4-ethyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK118667
SMILES N#Cc1c(NC(=O)CSc2nnc(n2CC)c2cccc(c2)C)sc2c1CCCC2
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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 C22H23N5OS2 MW 437.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5OS2/c1-3-27-20(15-8-6-7-14(2)11-15)25-26-22(27)29-13-19(28)24-21-17(12-23)16-9-4-5-10-18(16)30-21/h6-8,11H,3-5,9-10,13H2,1-2H3,(H,24,28)InChIKey
LPAIMIXNUIGGBE-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C4=CC(=CC=C4)C
InChI=1SC22H23N5OS2c132720(1586714(2)1115)252622(27)291319(28)242117(1223)169451018(16)3021h6811H3591013H212H3(H2428)
MFCD04127762
N(3cyano4567tetrahydro1benzothiophen2yl)2((4ethyl5(3methylphenyl)124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((4ethyl5(3methylphenyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000009305026
ZINC09305026
ZINC9305026
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