Vitas-M small molecule compound
N-{1-[5-({2-[(2-bromophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide
Catalog ID
STK221572
SMILES O=C(Nc1ccccc1Br)CSc1nnc(n1C)C(NC(=O)c1ccccc1F)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 C20H19BrFN5O2S MW 492.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrFN5O2S/c1-12(23-19(29)13-7-3-5-9-15(13)22)18-25-26-20(27(18)2)30-11-17(28)24-16-10-6-4-8-14(16)21/h3-10,12H,11H2,1-2H3,(H,23,29)(H,24,28)InChIKey
JDXLYMOBFDDYDV-UHFFFAOYSA-NSynonyms
CC(C1=NN=C(N1C)SCC(=O)NC2=CC=CC=C2Br)NC(=O)C3=CC=CC=C3F
InChI=1SC20H19BrFN5O2Sc112(2319(29)13735915(13)22)18252620(27(18)2)301117(28)24161064814(16)21h31012H11H212H3(H2329)(H2428)
MFCD07398841
N(1(5((2((2BROMOPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(5((2BROMOPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(5(2(2BROMOANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
ZINC000009263122
ZINC000009263125
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