Vitas-M small molecule compound

3-chloro-N'-[(1E)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propylidene]-1-benzothiophene-2-carbohydrazide

Catalog ID
STK424685
SMILES CC/C(=N\NC(=O)c1sc2c(c1Cl)cccc2)/C12CC3CC(C2)CC(C1)C3

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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 C22H25ClN2OS MW 400.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2OS/c1-2-18(22-10-13-7-14(11-22)9-15(8-13)12-22)24-25-21(26)20-19(23)16-5-3-4-6-17(16)27-20/h3-6,13-15H,2,7-12H2,1H3,(H,25,26)/b24-18+
InChIKey
XHCJBOINTSAFHL-HKOYGPOVSA-N
Synonyms

3chloroN((1E)1(tricyclo(3311~37~)dec1yl)propylidene)1benzothiophene2carbohydrazide
CCC(=NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C34CC5CC(C3)CC(C5)C4
CCC(=NNC(=O)c1sc2c(c1Cl)cccc2)C12CC3CC(C2)CC(C1)C3
InChI=1SC22H25ClN2OSc1218(221013714(1122)915(813)1222)242521(26)2019(23)16534617(16)2720h361315H2712H21H3(H2526)b2418+
N((1E)2ADAMANTANYL1AZABUT1ENYL)(3CHLOROBENZO(B)THIOPHEN2YL)CARBOXAMIDE
N((E)1(1adamantyl)propylideneamino)3chloro1benzothiophene2carboxamide
N(1(1ADAMANTYL)PROPYLIDENE)3CHLORO1BENZOTHIOPHENE2CARBOHYDRAZIDE
ZINC000004651596
ZINC33734369

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Available files

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