Vitas-M small molecule compound
2-({5-[(E)-{2-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]furan-2-yl}sulfanyl)-1H-benzimidazole
Catalog ID
STL428226
SMILES O1CCN(CC1)c1nc(N/N=C/c2ccc(o2)Sc2nc3c([nH]2)cccc3)nc(n1)N1CCOCC1
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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 C23H25N9O3S MW 507.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N9O3S/c1-2-4-18-17(3-1)25-23(26-18)36-19-6-5-16(35-19)15-24-30-20-27-21(31-7-11-33-12-8-31)29-22(28-20)32-9-13-34-14-10-32/h1-6,15H,7-14H2,(H,25,26)(H,27,28,29,30)/b24-15+InChIKey
NMZDOWADSACEGH-BUVRLJJBSA-NSynonyms
((1E)2(5BENZIMIDAZOL2YLTHIO(2FURYL))1AZAVINYL)(46DIMORPHOLIN4YL(135TRIAZIN2YL))AMINE
2((5((E)(2(46di(morpholin4yl)135triazin2yl)hydrazinylidene)methyl)furan2yl)sulfanyl)1Hbenzimidazole
C1COCCN1C2=NC(=NC(=N2)NN=CC3=CC=C(O3)SC4=NC5=CC=CC=C5N4)N6CCOCC6
InChI=1SC23H25N9O3Sc1241817(31)2523(2618)36196516(3519)152430202721(317113312831)2922(2820)3291334141032h1615H714H2(H2526)(H27282930)b2415+
MFCD02614863
N((E)(5(1Hbenzimidazol2ylsulfanyl)furan2yl)methylideneamino)46dimorpholin4yl135triazin2amine
O1CCN(CC1)c1nc(NN=Cc2ccc(o2)Sc2nc3c((nH)2)cccc3)nc(n1)N1CCOCC1
ZINC000009310227
ZINC35190690
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