Vitas-M small molecule compound
2-[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]-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK251245
SMILES N#Cc1c(NC(=O)CSc2nnc(n2C)CC(=O)Nc2ccc(c(c2)C)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 C24H26N6O2S2 MW 494.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O2S2/c1-14-8-9-16(10-15(14)2)26-21(31)11-20-28-29-24(30(20)3)33-13-22(32)27-23-18(12-25)17-6-4-5-7-19(17)34-23/h8-10H,4-7,11,13H2,1-3H3,(H,26,31)(H,27,32)InChIKey
JISLFCVIWGKLFO-UHFFFAOYSA-NSynonyms
2(5((2((3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)N(34dimethylphenyl)acetamide
2(5(2((3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)sulfanyl4methyl124triazol3yl)N(34dimethylphenyl)acetamide
CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C
InChI=1SC24H26N6O2S2c1148916(1015(14)2)2621(31)1120282924(30(20)3)331322(32)272318(1225)17645719(17)3423h810H471113H213H3(H2631)(H2732)
MFCD08670152
ZINC000009698963
ZINC09698963
ZINC9698963
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