Vitas-M small molecule compound
3-{2-[({[(E)-(4-chlorophenyl)methylidene]amino}oxy)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylpropan-1-amine
Catalog ID
STK609193
SMILES CN(CCCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccc(cc1)Cl)C)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 C22H26ClN7O MW 439.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN7O/c1-15-16(2)29(11-5-10-28(3)4)21-20(15)22-26-19(27-30(22)14-24-21)13-31-25-12-17-6-8-18(23)9-7-17/h6-9,12,14H,5,10-11,13H2,1-4H3/b25-12+InChIKey
CMNWABDAIRKMAC-BRJLIKDPSA-NSynonyms
903189-78-6(E)4chlorobenzaldehydeO((7(3(dimethylamino)propyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
3(2(((((E)(4chlorophenyl)methylidene)amino)oxy)methyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin7yl)NNdimethylpropan1amine
903189786
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CON=CC4=CC=C(C=C4)Cl)CCCN(C)C)C
CN(CCCn1c(C)c(c2c1ncn1c2nc(n1)CON=Cc1ccc(cc1)Cl)C)C
InChI=1SC22H26ClN7Oc11516(2)29(1151028(3)4)2120(15)222619(2730(22)142421)13312512176818(23)9717h691214H5101113H214H3b2512+
MFCD08286929
ZINC000009409561
ZINC102705704
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