Vitas-M small molecule compound
2-bromo-N-{1-[5-({2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK498225
SMILES CCn1c(SCC(=O)Nc2c(C)cccc2C)nnc1C(NC(=O)c1ccccc1Br)C
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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 C23H26BrN5O2S MW 516.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrN5O2S/c1-5-29-21(16(4)25-22(31)17-11-6-7-12-18(17)24)27-28-23(29)32-13-19(30)26-20-14(2)9-8-10-15(20)3/h6-12,16H,5,13H2,1-4H3,(H,25,31)(H,26,30)InChIKey
BITGHTUFEDEIKT-UHFFFAOYSA-NSynonyms
2BROMON((1R)1(5((2((26DIMETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2BROMON((1S)1(5((2((26DIMETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2bromoN(1(5((2((26dimethylphenyl)amino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)ethyl)benzamide
2BROMON(1(5(2(26DIMETHYLANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC=C2C)C)C(C)NC(=O)C3=CC=CC=C3Br
InChI=1SC23H26BrN5O2Sc152921(16(4)2522(31)1711671218(17)24)272823(29)321319(30)262014(2)981015(20)3h61216H513H214H3(H2531)(H2630)
MFCD05986535
ZINC000002843054
ZINC000002843055
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