Vitas-M small molecule compound
N-(4-bromo-3-chlorophenyl)-2-{4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenoxy}acetamide
Catalog ID
STL383852
SMILES COc1cc(/C=N/NC(=S)N)ccc1OCC(=O)Nc1ccc(c(c1)Cl)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 C17H16BrClN4O3S MW 471.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrClN4O3S/c1-25-15-6-10(8-21-23-17(20)27)2-5-14(15)26-9-16(24)22-11-3-4-12(18)13(19)7-11/h2-8H,9H2,1H3,(H,22,24)(H3,20,23,27)/b21-8+InChIKey
FLFHVRNNESZKOU-ODCIPOBUSA-NSynonyms
COC1=C(C=CC(=C1)C=NNC(=S)N)OCC(=O)NC2=CC(=C(C=C2)Br)Cl
COc1cc(C=NNC(=S)N)ccc1OCC(=O)Nc1ccc(c(c1)Cl)Br
InChI=1SC17H16BrClN4O3Sc12515610(8212317(20)27)2514(15)26916(24)22113412(18)13(19)711h28H9H21H3(H2224)(H3202327)b218+
MFCD02953726
N(4bromo3chlorophenyl)2(4((E)(2carbamothioylhydrazinylidene)methyl)2methoxyphenoxy)acetamide
N(4BROMO3CHLOROPHENYL)2(4((E)(CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)2METHOXYPHENOXY)ACETAMIDE
ZINC000000694337
ZINC33335238
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