Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[4-ethyl-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK116041
SMILES N#Cc1c(NC(=O)CSc2nnc(n2CC)c2ccccc2C)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(15-9-5-4-8-14(15)2)25-26-22(27)29-13-19(28)24-21-17(12-23)16-10-6-7-11-18(16)30-21/h4-5,8-9H,3,6-7,10-11,13H2,1-2H3,(H,24,28)
InChIKey
CSDYMGOZVHYTFP-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C4=CC=CC=C4C
InChI=1SC22H23N5OS2c132720(15954814(15)2)252622(27)291319(28)242117(1223)1610671118(16)3021h4589H367101113H212H3(H2428)
MFCD04128522
N(3cyano4567tetrahydro1benzothiophen2yl)2((4ethyl5(2methylphenyl)124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((4ethyl5(2methylphenyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000009305015
ZINC09305015
ZINC9305015

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Available files

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