Vitas-M small molecule compound
ethyl 1-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]pyrimidin-2-yl}piperidine-3-carboxylate
Catalog ID
STL132359
SMILES CCOC(=O)C1CCCN(C1)c1ncc(c(n1)N)C(=O)Nc1ccc(cc1)OCC
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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 C21H27N5O4 MW 413.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O4/c1-3-29-16-9-7-15(8-10-16)24-19(27)17-12-23-21(25-18(17)22)26-11-5-6-14(13-26)20(28)30-4-2/h7-10,12,14H,3-6,11,13H2,1-2H3,(H,24,27)(H2,22,23,25)InChIKey
UUANSBOBHFGJDP-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2N)N3CCCC(C3)C(=O)OCC
ethyl1(4amino5((4ethoxyphenyl)carbamoyl)pyrimidin2yl)piperidine3carboxylate
InChI=1SC21H27N5O4c1329169715(81016)2419(27)17122321(2518(17)22)26115614(1326)20(28)3042h7101214H361113H212H3(H2427)(H2222325)
MFCD20752056
ZINC000067336493
ZINC000067336495
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