Vitas-M small molecule compound
(2E)-3-(3,4-dimethoxyphenyl)-N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]prop-2-enamide
Catalog ID
STK217874
SMILES COc1ccc2c(c1)c(CCN/C(=N\C(=O)/C=C/c1ccc(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 C29H32N6O4 MW 528.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N6O4/c1-18-14-19(2)33-29(32-18)35-28(30-13-12-21-17-31-24-9-8-22(37-3)16-23(21)24)34-27(36)11-7-20-6-10-25(38-4)26(15-20)39-5/h6-11,14-17,31H,12-13H2,1-5H3,(H2,30,32,33,34,35,36)/b11-7+InChIKey
PEAVCUMMATUPSB-YRNVUSSQSA-NSynonyms
(1E4E)5(34DIMETHOXYPHENYL)1((46DIMETHYLPYRIMIDIN2YL)AMINO)1((2(5METHOXYINDOL3YL)ETHYL)AMINO)2AZAPENTA14DIEN3ONE
(2E)3(34dimethoxyphenyl)N((E)((46dimethylpyrimidin2yl)amino)((2(5methoxy1Hindol3yl)ethyl)amino)methylidene)prop2enamide
(E)3(34dimethoxyphenyl)N(N(46dimethylpyrimidin2yl)N(2(5methoxy1Hindol3yl)ethyl)carbamimidoyl)prop2enamide
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)OC)NC(=O)C=CC4=CC(=C(C=C4)OC)OC)C
COc1ccc2c(c1)c(CCNC(=NC(=O)C=Cc1ccc(c(c1)OC)OC)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC29H32N6O4c1181419(2)3329(3218)3528(301312211731249822(373)1623(21)24)3427(36)1172061025(384)26(1520)395h611141731H1213H215H3(H2303233343536)b117+
MFCD06755194
ZINC000010059719
ZINC10059719
Check stock
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Check stock on Vitas-MAvailable files
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