Vitas-M small molecule compound
N-{1-[5-({2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-2-fluorobenzamide
Catalog ID
STL182241
SMILES CCn1c(SCC(=O)Nc2sc(c(n2)C)C)nnc1C(C(C)C)NC(=O)c1ccccc1F
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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 C22H27FN6O2S2 MW 490.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27FN6O2S2/c1-6-29-19(18(12(2)3)26-20(31)15-9-7-8-10-16(15)23)27-28-22(29)32-11-17(30)25-21-24-13(4)14(5)33-21/h7-10,12,18H,6,11H2,1-5H3,(H,26,31)(H,24,25,30)InChIKey
LBSQORYVECKQNG-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=NC(=C(S2)C)C)C(C(C)C)NC(=O)C3=CC=CC=C3F
InChI=1SC22H27FN6O2S2c162919(18(12(2)3)2620(31)159781016(15)23)272822(29)321117(30)25212413(4)14(5)3321h7101218H611H215H3(H2631)(H242530)
MFCD22125692
N(1(5((2((45dimethyl13thiazol2yl)amino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)2methylpropyl)2fluorobenzamide
N(1(5(2((45dimethyl13thiazol2yl)amino)2oxoethyl)sulfanyl4ethyl124triazol3yl)2methylpropyl)2fluorobenzamide
ZINC000008884246
ZINC000008884250
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