Vitas-M small molecule compound
N-[1-(5-{[1-(tert-butylamino)-1-oxopropan-2-yl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]-2-fluorobenzamide
Catalog ID
STK297682
SMILES O=C(C(Sc1nnc(n1C)C(NC(=O)c1ccccc1F)C)C)NC(C)(C)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 C19H26FN5O2S MW 407.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26FN5O2S/c1-11(21-17(27)13-9-7-8-10-14(13)20)15-23-24-18(25(15)6)28-12(2)16(26)22-19(3,4)5/h7-12H,1-6H3,(H,21,27)(H,22,26)InChIKey
GMCQIHWGPLSJIU-UHFFFAOYSA-NSynonyms
CC(C1=NN=C(N1C)SC(C)C(=O)NC(C)(C)C)NC(=O)C2=CC=CC=C2F
InChI=1SC19H26FN5O2Sc111(2117(27)139781014(13)20)15232418(25(15)6)2812(2)16(26)2219(34)5h712H16H3(H2127)(H2226)
MFCD09876603
N(1(5((1(tertbutylamino)1oxopropan2yl)sulfanyl)4methyl4H124triazol3yl)ethyl)2fluorobenzamide
N(1(5(1(tertbutylamino)1oxopropan2yl)sulfanyl4methyl124triazol3yl)ethyl)2fluorobenzamide
ZINC000012383978
ZINC000012383981
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