Vitas-M small molecule compound
2-{[5-(4-bromothiophen-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-3-nitrophenyl)acetamide
Catalog ID
STK434851
SMILES O=C(Nc1ccc(c(c1)[N+](=O)[O-])Cl)CSc1nnc(n1C)c1scc(c1)Br
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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 C15H11BrClN5O3S2 MW 488.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrClN5O3S2/c1-21-14(12-4-8(16)6-26-12)19-20-15(21)27-7-13(23)18-9-2-3-10(17)11(5-9)22(24)25/h2-6H,7H2,1H3,(H,18,23)InChIKey
RRDQMWFWBJMITM-UHFFFAOYSA-NSynonyms
2((5(4BROMOTHIOPHEN2YL)4METHYL124TRIAZOL3YL)SULFANYL)N(4CHLORO3NITROPHENYL)ACETAMIDE
2((5(4bromothiophen2yl)4methyl4H124triazol3yl)sulfanyl)N(4chloro3nitrophenyl)acetamide
2(5(4BROMO(2THIENYL))4METHYL(124TRIAZOL3YLTHIO))N(4CHLORO3NITROPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)(N+)(=O)(O))C3=CC(=CS3)Br
InChI=1SC15H11BrClN5O3S2c12114(1248(16)62612)192015(21)27713(23)1892310(17)11(59)22(24)25h26H7H21H3(H1823)
MFCD03943176
O=C(Nc1ccc(c(c1)(N+)(=O)(O))Cl)CSc1nnc(n1C)c1scc(c1)Br
ZINC000020427657
ZINC20427657
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