Vitas-M small molecule compound
(2E,2'E,2''E)-N,N',N''-(pyrimidine-2,4,6-triyltribenzene-4,1-diyl)tris(3-phenylprop-2-enamide)
Catalog ID
STK064779
SMILES O=C(Nc1ccc(cc1)c1cc(nc(n1)c1ccc(cc1)NC(=O)/C=C/c1ccccc1)c1ccc(cc1)NC(=O)/C=C/c1ccccc1)/C=C/c1ccccc1
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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 C49H37N5O3 MW 743.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C49H37N5O3/c55-46(31-16-35-10-4-1-5-11-35)50-41-25-19-38(20-26-41)44-34-45(39-21-27-42(28-22-39)51-47(56)32-17-36-12-6-2-7-13-36)54-49(53-44)40-23-29-43(30-24-40)52-48(57)33-18-37-14-8-3-9-15-37/h1-34H,(H,50,55)(H,51,56)(H,52,57)/b31-16+,32-17+,3InChIKey
DAJKAUJNOFZHCG-HZAPWMNRSA-NSynonyms
(2E2E2E)NNN(PYRIMIDINE246TRIYLTRIBENZENE41DIYL)TRIS(3PHENYLPROP2ENAMIDE)
(E)N(4(26BIS(4(((E)3PHENYLPROP2ENOYL)AMINO)PHENYL)PYRIMIDIN4YL)PHENYL)3PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)C3=CC(=NC(=N3)C4=CC=C(C=C4)NC(=O)C=CC5=CC=CC=C5)C6=CC=C(C=C6)NC(=O)C=CC7=CC=CC=C7
InChI=1SC49H37N5O3c5546(311635104151135)5041251938(202641)443445(39212742(282239)5147(56)321736126271336)5449(5344)40232943(302440)5248(57)331837148391537h134H(H5055)(H5156)(H5257)b3116+3217+3318+
MFCD00304612
O=C(Nc1ccc(cc1)c1cc(nc(n1)c1ccc(cc1)NC(=O)C=Cc1ccccc1)c1ccc(cc1)NC(=O)C=Cc1ccccc1)C=Cc1ccccc1
STK064779
ZINC000150357075
ZINC150357075
Check stock
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Check stock on Vitas-MAvailable files
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