Vitas-M small molecule compound
(E)-1-(4-chlorophenyl)-N-{[8,9-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Catalog ID
STK612263
SMILES CC(Cn1c(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 C21H23ClN6O MW 410.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN6O/c1-13(2)10-27-15(4)14(3)19-20(27)23-12-28-21(19)25-18(26-28)11-29-24-9-16-5-7-17(22)8-6-16/h5-9,12-13H,10-11H2,1-4H3/b24-9+InChIKey
NCDPERMGQXIOKX-PGGKNCGUSA-NSynonyms
903193-40-8(E)1(4chlorophenyl)N((89dimethyl7(2methylpropyl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)methanimine
(E)4chlorobenzaldehydeO((7isobutyl89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
903193408
CC(Cn1c(C)c(c2c1ncn1c2nc(n1)CON=Cc1ccc(cc1)Cl)C)C
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CON=CC4=CC=C(C=C4)Cl)CC(C)C)C
InChI=1SC21H23ClN6Oc113(2)102715(4)14(3)1920(27)23122821(19)2518(2628)1129249165717(22)8616h591213H1011H214H3b249+
MFCD08287055
ZINC000006670236
ZINC35769834
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