Vitas-M small molecule compound

2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]acetohydrazide

Catalog ID
STL231827
SMILES COc1c(/C=N/NC(=O)CSc2nnc(s2)SCc2ccccc2)ccc(c1OC)OC

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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 C21H22N4O4S3 MW 490.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S3/c1-27-16-10-9-15(18(28-2)19(16)29-3)11-22-23-17(26)13-31-21-25-24-20(32-21)30-12-14-7-5-4-6-8-14/h4-11H,12-13H2,1-3H3,(H,23,26)/b22-11+
InChIKey
QNIFGLWNAGVJJA-SSDVNMTOSA-N
Synonyms
315200-89-6
(E)2((5(benzylthio)134thiadiazol2yl)thio)N(234trimethoxybenzylidene)acetohydrazide
2((5(benzylsulfanyl)134thiadiazol2yl)sulfanyl)N((E)(234trimethoxyphenyl)methylidene)acetohydrazide
2((5BENZYLSULFANYL134THIADIAZOL2YL)SULFANYL)N((E)(234TRIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
315200896
COC1=C(C(=C(C=C1)C=NNC(=O)CSC2=NN=C(S2)SCC3=CC=CC=C3)OC)OC
COc1c(C=NNC(=O)CSc2nnc(s2)SCc2ccccc2)ccc(c1OC)OC
InChI=1SC21H22N4O4S3c1271610915(18(282)19(16)293)11222317(26)133121252420(3221)3012147546814h411H1213H213H3(H2326)b2211+
MFCD02075650
ZINC000002335916
ZINC33361379

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Available files

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