Vitas-M small molecule compound

N-{[5-({2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-3-methylbenzamide

Catalog ID
STK118644
SMILES N#Cc1c(NC(=O)CSc2nnc(n2C)CNC(=O)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 C23H24N6O2S2 MW 480.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O2S2/c1-14-6-5-7-15(10-14)21(31)25-12-19-27-28-23(29(19)2)32-13-20(30)26-22-17(11-24)16-8-3-4-9-18(16)33-22/h5-7,10H,3-4,8-9,12-13H2,1-2H3,(H,25,31)(H,26,30)
InChIKey
QCLUCVZDGWXXIB-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC23H24N6O2S2c11465715(1014)21(31)251219272823(29(19)2)321320(30)262217(1124)16834918(16)3322h5710H34891213H212H3(H2531)(H2630)
MFCD04127867
N((5((2((3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)methyl)3methylbenzamide
N((5(2((3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)sulfanyl4methyl124triazol3yl)methyl)3methylbenzamide
ZINC000009805552
ZINC09805552
ZINC9805552

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Available files

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