Vitas-M small molecule compound

ethyl 4-amino-2-({2-[ethyl(phenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate

Catalog ID
STL419416
SMILES CCOC(=O)c1cnc(nc1N)SCC(=O)N(c1ccccc1)CC

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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 C17H20N4O3S MW 360.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O3S/c1-3-21(12-8-6-5-7-9-12)14(22)11-25-17-19-10-13(15(18)20-17)16(23)24-4-2/h5-10H,3-4,11H2,1-2H3,(H2,18,19,20)
InChIKey
BFEAKVVLZKJQTK-UHFFFAOYSA-N
Synonyms

CCN(C1=CC=CC=C1)C(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC
ethyl4amino2((2(ethyl(phenyl)amino)2oxoethyl)sulfanyl)pyrimidine5carboxylate
ETHYL4AMINO2(2(NETHYLANILINO)2OXOETHYL)SULFANYLPYRIMIDINE5CARBOXYLATE
InChI=1SC17H20N4O3Sc1321(128657912)14(22)112517191013(15(18)2017)16(23)2442h510H3411H212H3(H2181920)
MFCD07178710
ZINC000006702640
ZINC06702640
ZINC6702640

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Available files

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