Vitas-M small molecule compound

2-({5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N'-[(1Z)-1-(4-methoxyphenyl)ethylidene]acetohydrazide

Catalog ID
STK103798
SMILES COc1ccc(cc1)/C(=N\NC(=O)CSc1nnc(s1)SCc1ccccc1Cl)/C

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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 C20H19ClN4O2S3 MW 479.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O2S3/c1-13(14-7-9-16(27-2)10-8-14)22-23-18(26)12-29-20-25-24-19(30-20)28-11-15-5-3-4-6-17(15)21/h3-10H,11-12H2,1-2H3,(H,23,26)/b22-13-
InChIKey
IIIOZCRFRVKPNI-XKZIYDEJSA-N
Synonyms
487024-42-0
(Z)2((5((2chlorobenzyl)thio)134thiadiazol2yl)thio)N(1(4methoxyphenyl)ethylidene)acetohydrazide
2((5((2CHLOROBENZYL)SULFANYL)134THIADIAZOL2YL)SULFANYL)N((1Z)1(4METHOXYPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
2((5((2CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)SULFANYL)N((Z)1(4METHOXYPHENYL)ETHYLIDENEAMINO)ACETAMIDE
487024420
CC(=NNC(=O)CSC1=NN=C(S1)SCC2=CC=CC=C2Cl)C3=CC=C(C=C3)OC
COc1ccc(cc1)C(=NNC(=O)CSc1nnc(s1)SCc1ccccc1Cl)C
InChI=1SC20H19ClN4O2S3c113(147916(272)10814)222318(26)122920252419(3020)281115534617(15)21h310H1112H212H3(H2326)b2213
MFCD03219796
N((1Z)2(4METHOXYPHENYL)1AZAPROP1ENYL)2(5((2CHLOROPHENYL)METHYLTHIO)(134THIADIAZOL2YLTHIO))ACETAMIDE
ZINC000008817327
ZINC33530531

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.