Vitas-M small molecule compound
N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]-2-methoxybenzamide
Catalog ID
STK231450
SMILES COc1ccc2c(c1)c(CCN/C(=N\C(=O)c1ccccc1OC)/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 C26H28N6O3 MW 472.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O3/c1-16-13-17(2)30-26(29-16)32-25(31-24(33)20-7-5-6-8-23(20)35-4)27-12-11-18-15-28-22-10-9-19(34-3)14-21(18)22/h5-10,13-15,28H,11-12H2,1-4H3,(H2,27,29,30,31,32,33)InChIKey
ZBPVDNTXOROCHW-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2(5METHOXYINDOL3YL)ETHYL)AMINO)1(2METHOXYPHENYL)2AZAPROP2EN1ONE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)OC)NC(=O)C4=CC=CC=C4OC)C
COc1ccc2c(c1)c(CCNC(=NC(=O)c1ccccc1OC)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC26H28N6O3c1161317(2)3026(2916)3225(3124(33)20756823(20)354)2712111815282210919(343)1421(18)22h510131528H1112H214H3(H2272930313233)
MFCD07181063
N((E)((46dimethylpyrimidin2yl)amino)((2(5methoxy1Hindol3yl)ethyl)amino)methylidene)2methoxybenzamide
N(N(46dimethylpyrimidin2yl)N(2(5methoxy1Hindol3yl)ethyl)carbamimidoyl)2methoxybenzamide
ZINC000018222232
ZINC18222232
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