Vitas-M small molecule compound
N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]-3-methylbenzamide
Catalog ID
STK356301
SMILES COc1ccc2c(c1)c(CCN/C(=N\C(=O)c1cccc(c1)C)/Nc1nc(C)cc(n1)C)c[nH]2
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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 C26H28N6O2 MW 456.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O2/c1-16-6-5-7-19(12-16)24(33)31-25(32-26-29-17(2)13-18(3)30-26)27-11-10-20-15-28-23-9-8-21(34-4)14-22(20)23/h5-9,12-15,28H,10-11H2,1-4H3,(H2,27,29,30,31,32,33)InChIKey
OHYOKEFZXYMOIU-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NC(=NCCC2=CNC3=C2C=C(C=C3)OC)NC4=NC(=CC(=N4)C)C
COc1ccc2c(c1)c(CCNC(=NC(=O)c1cccc(c1)C)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC26H28N6O2c11665719(1216)24(33)3125(32262917(2)1318(3)3026)271110201528239821(344)1422(20)23h59121528H1011H214H3(H2272930313233)
MFCD08572974
N((E)((46dimethylpyrimidin2yl)amino)((2(5methoxy1Hindol3yl)ethyl)amino)methylidene)3methylbenzamide
N(N(46dimethylpyrimidin2yl)N(2(5methoxy1Hindol3yl)ethyl)carbamimidoyl)3methylbenzamide
ZINC000014729810
ZINC14729810
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