Vitas-M small molecule compound
N-{1-[5-({2-[(4-bromo-2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}-2-chlorobenzamide
Catalog ID
STK140020
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2C)C)Br)nnc1C(NC(=O)c1ccccc1Cl)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 C23H25BrClN5O2S MW 550.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrClN5O2S/c1-5-30-21(15(4)26-22(32)16-8-6-7-9-18(16)25)28-29-23(30)33-12-20(31)27-19-11-10-17(24)13(2)14(19)3/h6-11,15H,5,12H2,1-4H3,(H,26,32)(H,27,31)InChIKey
KFVRICZIBXXFLE-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C(=C(C=C2)Br)C)C)C(C)NC(=O)C3=CC=CC=C3Cl
InChI=1SC23H25BrClN5O2Sc153021(15(4)2622(32)16867918(16)25)282923(30)331220(31)2719111017(24)13(2)14(19)3h61115H512H214H3(H2632)(H2731)
MFCD04212087
N(1(5((2((4BROMO23DIMETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)2CHLOROBENZAMIDE
N(1(5(2(4BROMO23DIMETHYLANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)2CHLOROBENZAMIDE
ZINC000001132369
ZINC000001132371
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