Vitas-M small molecule compound
2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(3-bromo-4-methoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK076420
SMILES COc1ccc(cc1Br)/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H17BrN4O2S3 MW 509.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN4O2S3/c1-26-16-8-7-14(9-15(16)20)10-21-22-17(25)12-28-19-24-23-18(29-19)27-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H,22,25)/b21-10+InChIKey
RGAKYKSNHIUBET-UFFVCSGVSA-NSynonyms
315201-72-0(E)2((5(benzylthio)134thiadiazol2yl)thio)N(3bromo4methoxybenzylidene)acetohydrazide
2((5(BENZYLSULFANYL)134THIADIAZOL2YL)SULFANYL)N((E)(3BROMO4METHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
2((5BENZYLSULFANYL134THIADIAZOL2YL)SULFANYL)N((E)(3BROMO4METHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
315201720
COC1=C(C=C(C=C1)C=NNC(=O)CSC2=NN=C(S2)SCC3=CC=CC=C3)Br
COc1ccc(cc1Br)C=NNC(=O)CSc1nnc(s1)SCc1ccccc1
InChI=1SC19H17BrN4O2S3c126168714(915(16)20)10212217(25)122819242318(2919)2711135324613h210H1112H21H3(H2225)b2110+
MFCD02075734
STK076420
ZINC000001875075
ZINC33345689
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