Vitas-M small molecule compound
N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]-3,4,5-trimethoxybenzamide
Catalog ID
STK217871
SMILES COc1ccc2c(c1)c(CCN/C(=N\C(=O)c1cc(OC)c(c(c1)OC)OC)/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 C28H32N6O5 MW 532.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N6O5/c1-16-11-17(2)32-28(31-16)34-27(29-10-9-18-15-30-22-8-7-20(36-3)14-21(18)22)33-26(35)19-12-23(37-4)25(39-6)24(13-19)38-5/h7-8,11-15,30H,9-10H2,1-6H3,(H2,29,31,32,33,34,35)InChIKey
ATLCMKPXQYHVLB-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2(5METHOXYINDOL3YL)ETHYL)AMINO)1(345TRIMETHOXYPHENYL)2AZAPROP2EN1ONE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)OC)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C
COc1ccc2c(c1)c(CCNC(=NC(=O)c1cc(OC)c(c(c1)OC)OC)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC28H32N6O5c1161117(2)3228(3116)3427(29109181530228720(363)1421(18)22)3326(35)191223(374)25(396)24(1319)385h78111530H910H216H3(H2293132333435)
MFCD06755191
N((E)((46dimethylpyrimidin2yl)amino)((2(5methoxy1Hindol3yl)ethyl)amino)methylidene)345trimethoxybenzamide
N(N(46dimethylpyrimidin2yl)N(2(5methoxy1Hindol3yl)ethyl)carbamimidoyl)345trimethoxybenzamide
ZINC000100126659
ZINC100126659
Check stock
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Check stock on Vitas-MAvailable files
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