Vitas-M small molecule compound

2-(4-{4-amino-5-[(4-methylphenyl)sulfonyl]pyrimidin-2-yl}piperazin-1-yl)-1-(pyrrolidin-1-yl)ethanone

Catalog ID
STL167436
SMILES Cc1ccc(cc1)S(=O)(=O)c1cnc(nc1N)N1CCN(CC1)CC(=O)N1CCCC1

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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 C21H28N6O3S MW 444.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O3S/c1-16-4-6-17(7-5-16)31(29,30)18-14-23-21(24-20(18)22)27-12-10-25(11-13-27)15-19(28)26-8-2-3-9-26/h4-7,14H,2-3,8-13,15H2,1H3,(H2,22,23,24)
InChIKey
NSHFVCYONHNHQH-UHFFFAOYSA-N
Synonyms

2(4(4amino5((4methylphenyl)sulfonyl)pyrimidin2yl)piperazin1yl)1(pyrrolidin1yl)ethanone
2(4(4amino5(4methylphenyl)sulfonylpyrimidin2yl)piperazin1yl)1pyrrolidin1ylethanone
CC1=CC=C(C=C1)S(=O)(=O)C2=CN=C(N=C2N)N3CCN(CC3)CC(=O)N4CCCC4
InChI=1SC21H28N6O3Sc1164617(7516)31(2930)18142321(2420(18)22)27121025(111327)1519(28)26823926h4714H2381315H21H3(H2222324)
MFCD20751725
ZINC000071771786
ZINC71771786

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Available files

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