Vitas-M small molecule compound
2-bromo-N-[(5-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]benzamide
Catalog ID
STK274024
SMILES O=C(NC(C)(C)C)CSc1nnc(n1C)CNC(=O)c1ccccc1Br
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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 C17H22BrN5O2S MW 440.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22BrN5O2S/c1-17(2,3)20-14(24)10-26-16-22-21-13(23(16)4)9-19-15(25)11-7-5-6-8-12(11)18/h5-8H,9-10H2,1-4H3,(H,19,25)(H,20,24)InChIKey
HJUWOVIPQJHMCF-UHFFFAOYSA-NSynonyms
2BROMON((5((2(TERTBUTYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
2bromoN((5(2(tertbutylamino)2oxoethyl)sulfanyl4methyl124triazol3yl)methyl)benzamide
2BROMON(5(TERTBUTYLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)BENZAMIDE
CC(C)(C)NC(=O)CSC1=NN=C(N1C)CNC(=O)C2=CC=CC=C2Br
InChI=1SC17H22BrN5O2Sc117(23)2014(24)102616222113(23(16)4)91915(25)11756812(11)18h58H910H214H3(H1925)(H2024)
MFCD09268331
ZINC000009615116
ZINC09615116
ZINC9615116
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