Vitas-M small molecule compound
2-[5-({2-[(4-bromo-2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-(2-methylphenyl)acetamide
Catalog ID
STK289063
SMILES O=C(Nc1ccc(cc1F)Br)CSc1nnc(n1C)CC(=O)Nc1ccccc1C
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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/c1-12-5-3-4-6-15(12)23-18(28)10-17-25-26-20(27(17)2)30-11-19(29)24-16-8-7-13(21)9-14(16)22/h3-9H,10-11H2,1-2H3,(H,23,28)(H,24,29)InChIKey
RLDCFNVITUNDKM-UHFFFAOYSA-NSynonyms
2(5((2((4BROMO2FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(2METHYLPHENYL)ACETAMIDE
2(5(2(4BROMO2FLUOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(2METHYLPHENYL)ACETAMIDE
CC1=CC=CC=C1NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3)Br)F
InChI=1SC20H19BrFN5O2Sc112534615(12)2318(28)1017252620(27(17)2)301119(29)24168713(21)914(16)22h39H1011H212H3(H2328)(H2429)
MFCD06627459
ZINC000002879634
ZINC02879634
ZINC2879634
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