Vitas-M small molecule compound
tert-butyl 4-{4-amino-5-[(4-methoxyphenyl)carbamoyl]pyrimidin-2-yl}piperazine-1-carboxylate
Catalog ID
STL167657
SMILES COc1ccc(cc1)NC(=O)c1cnc(nc1N)N1CCN(CC1)C(=O)OC(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 C21H28N6O4 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O4/c1-21(2,3)31-20(29)27-11-9-26(10-12-27)19-23-13-16(17(22)25-19)18(28)24-14-5-7-15(30-4)8-6-14/h5-8,13H,9-12H2,1-4H3,(H,24,28)(H2,22,23,25)InChIKey
OWNLHSCKMVGFBW-UHFFFAOYSA-NSynonyms
CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C(C(=N2)N)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC21H28N6O4c121(23)3120(29)2711926(101227)19231316(17(22)2519)18(28)24145715(304)8614h5813H912H214H3(H2428)(H2222325)
MFCD20752132
tertbutyl4(4amino5((4methoxyphenyl)carbamoyl)pyrimidin2yl)piperazine1carboxylate
ZINC000071772270
ZINC71772270
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