Vitas-M small molecule compound

ethyl 1-{4-amino-5-[(3-methylphenyl)sulfonyl]pyrimidin-2-yl}piperidine-3-carboxylate

Catalog ID
STL132297
SMILES CCOC(=O)C1CCCN(C1)c1ncc(c(n1)N)S(=O)(=O)c1cccc(c1)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 C19H24N4O4S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O4S/c1-3-27-18(24)14-7-5-9-23(12-14)19-21-11-16(17(20)22-19)28(25,26)15-8-4-6-13(2)10-15/h4,6,8,10-11,14H,3,5,7,9,12H2,1-2H3,(H2,20,21,22)
InChIKey
VKOYKQFAOYJVDH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCCN(C1)C2=NC=C(C(=N2)N)S(=O)(=O)C3=CC=CC(=C3)C
ethyl1(4amino5((3methylphenyl)sulfonyl)pyrimidin2yl)piperidine3carboxylate
ethyl1(4amino5(3methylphenyl)sulfonylpyrimidin2yl)piperidine3carboxylate
InChI=1SC19H24N4O4Sc132718(24)1475923(1214)19211116(17(20)2219)28(2526)1584613(2)1015h468101114H357912H212H3(H2202122)
MFCD20751950
ZINC000067336364
ZINC000067336369

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Available files

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