Vitas-M small molecule compound
(2E)-3-[4-(propan-2-yl)phenyl]-N-(pyrimidin-2-yl)prop-2-enamide
Catalog ID
STK421892
SMILES O=C(Nc1ncccn1)/C=C/c1ccc(cc1)C(C)C
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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 C16H17N3O MW 267.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O/c1-12(2)14-7-4-13(5-8-14)6-9-15(20)19-16-17-10-3-11-18-16/h3-12H,1-2H3,(H,17,18,19,20)/b9-6+InChIKey
WJTPDEJDGYTXEI-RMKNXTFCSA-NSynonyms
362473-12-9(2E)3(4(propan2yl)phenyl)N(pyrimidin2yl)prop2enamide
(E)3(4PROPAN2YLPHENYL)NPYRIMIDIN2YLPROP2ENAMIDE
362473129
CC(C)C1=CC=C(C=C1)C=CC(=O)NC2=NC=CC=N2
InChI=1SC16H17N3Oc112(2)147413(5814)6915(20)191617103111816h312H12H3(H17181920)b96+
MFCD01336424
O=C(Nc1ncccn1)C=Cc1ccc(cc1)C(C)C
ZINC000000994644
ZINC00994644
ZINC994644
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