Vitas-M small molecule compound

ethyl 4-[(4-bromophenyl)amino]-2-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidine-5-carboxylate

Catalog ID
STL240313
SMILES CCOC(=O)c1cnc(nc1Nc1ccc(cc1)Br)n1nc(cc1C)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 C18H18BrN5O2 MW 416.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN5O2/c1-4-26-17(25)15-10-20-18(24-12(3)9-11(2)23-24)22-16(15)21-14-7-5-13(19)6-8-14/h5-10H,4H2,1-3H3,(H,20,21,22)
InChIKey
RRMDLXVUNNKCBQ-UHFFFAOYSA-N
Synonyms
1003989-18-1
1003989181
CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)Br)N3C(=CC(=N3)C)C
ethyl4((4bromophenyl)amino)2(35dimethyl1Hpyrazol1yl)pyrimidine5carboxylate
ETHYL4(4BROMOANILINO)2(35DIMETHYLPYRAZOL1YL)PYRIMIDINE5CARBOXYLATE
InChI=1SC18H18BrN5O2c142617(25)15102018(2412(3)911(2)2324)2216(15)21147513(19)6814h510H4H213H3(H202122)
MFCD04018108
ZINC000002445402
ZINC02445402
ZINC2445402

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.