Vitas-M small molecule compound
N-{[5-({2-[(4-bromo-2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-2-(2,6-dimethylphenoxy)acetamide
Catalog ID
STK124120
SMILES O=C(NCc1nnc(n1C)SCC(=O)Nc1c(C)cc(cc1C)Br)COc1c(C)cccc1C
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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 C24H28BrN5O3S MW 546.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28BrN5O3S/c1-14-7-6-8-15(2)23(14)33-12-20(31)26-11-19-28-29-24(30(19)5)34-13-21(32)27-22-16(3)9-18(25)10-17(22)4/h6-10H,11-13H2,1-5H3,(H,26,31)(H,27,32)InChIKey
TXUHCJRXOLIGKI-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)C)OCC(=O)NCC2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3C)Br)C
InChI=1SC24H28BrN5O3Sc11476815(2)23(14)331220(31)261119282924(30(19)5)341321(32)272216(3)918(25)1017(22)4h610H1113H215H3(H2631)(H2732)
MFCD04086102
N((5((2((4BROMO26DIMETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)2(26DIMETHYLPHENOXY)ACETAMIDE
N((5(2(4BROMO26DIMETHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)2(26DIMETHYLPHENOXY)ACETAMIDE
ZINC000097947929
ZINC97947929
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