Vitas-M small molecule compound
N'-[(E)-{4-[bis(2-chloroethyl)amino]phenyl}methylidene]-2-{[4-methyl-6-(piperidin-1-yl)pyrimidin-2-yl]sulfanyl}acetohydrazide
Catalog ID
STL146929
SMILES ClCCN(c1ccc(cc1)/C=N/NC(=O)CSc1nc(C)cc(n1)N1CCCCC1)CCCl
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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 C23H30Cl2N6OS MW 509.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30Cl2N6OS/c1-18-15-21(31-11-3-2-4-12-31)28-23(27-18)33-17-22(32)29-26-16-19-5-7-20(8-6-19)30(13-9-24)14-10-25/h5-8,15-16H,2-4,9-14,17H2,1H3,(H,29,32)/b26-16+InChIKey
FUVHTPQNJDNBCU-WGOQTCKBSA-NSynonyms
303965-64-2(E)N(4(bis(2chloroethyl)amino)benzylidene)2((4methyl6(piperidin1yl)pyrimidin2yl)thio)acetohydrazide
303965642
CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC=C(C=C2)N(CCCl)CCCl)N3CCCCC3
ClCCN(c1ccc(cc1)C=NNC(=O)CSc1nc(C)cc(n1)N1CCCCC1)CCCl
InChI=1SC23H30Cl2N6OSc1181521(31113241231)2823(2718)331722(32)292616195720(8619)30(13924)141025h581516H2491417H21H3(H2932)b2616+
MFCD01558263
N((E)(4(bis(2chloroethyl)amino)phenyl)methylidene)2((4methyl6(piperidin1yl)pyrimidin2yl)sulfanyl)acetohydrazide
N((E)(4(bis(2chloroethyl)amino)phenyl)methylideneamino)2(4methyl6piperidin1ylpyrimidin2yl)sulfanylacetamide
ZINC000100690456
ZINC103219459
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