Vitas-M small molecule compound
2-{8,9-dimethyl-2-[({[(E)-phenylmethylidene]amino}oxy)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylethanamine
Catalog ID
STK613299
SMILES CN(CCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccccc1)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 C21H25N7O MW 391.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N7O/c1-15-16(2)27(11-10-26(3)4)20-19(15)21-24-18(25-28(21)14-22-20)13-29-23-12-17-8-6-5-7-9-17/h5-9,12,14H,10-11,13H2,1-4H3/b23-12+InChIKey
ZGAQWNZOLRQGCP-FSJBWODESA-NSynonyms
903588-68-1(E)benzaldehydeO((7(2(dimethylamino)ethyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
2(89dimethyl2(((((E)phenylmethylidene)amino)oxy)methyl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin7yl)NNdimethylethanamine
903588681
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CON=CC4=CC=CC=C4)CCN(C)C)C
CN(CCn1c(C)c(c2c1ncn1c2nc(n1)CON=Cc1ccccc1)C)C
InChI=1SC21H25N7Oc11516(2)27(111026(3)4)2019(15)212418(2528(21)142220)13292312178657917h591214H101113H214H3b2312+
MFCD08291829
ZINC000006760305
ZINC35805423
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