Vitas-M small molecule compound
2-(4-{4-amino-5-[(3-methylphenyl)sulfonyl]pyrimidin-2-yl}piperazin-1-yl)-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL167593
SMILES Cc1cccc(c1)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/c1-16-5-4-6-17(13-16)31(29,30)18-14-23-21(24-20(18)22)27-11-9-25(10-12-27)15-19(28)26-7-2-3-8-26/h4-6,13-14H,2-3,7-12,15H2,1H3,(H2,22,23,24)InChIKey
ATUIUCXELMHRSI-UHFFFAOYSA-NSynonyms
2(4(4amino5((3methylphenyl)sulfonyl)pyrimidin2yl)piperazin1yl)1(pyrrolidin1yl)ethanone
2(4(4amino5(3methylphenyl)sulfonylpyrimidin2yl)piperazin1yl)1pyrrolidin1ylethanone
CC1=CC(=CC=C1)S(=O)(=O)C2=CN=C(N=C2N)N3CCN(CC3)CC(=O)N4CCCC4
InChI=1SC21H28N6O3Sc11654617(1316)31(2930)18142321(2420(18)22)2711925(101227)1519(28)26723826h461314H2371215H21H3(H2222324)
MFCD20751983
ZINC000071772161
ZINC71772161
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