Vitas-M small molecule compound
1-(3,4-dihydroquinolin-1(2H)-yl)-4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}butan-1-one
Catalog ID
STK340350
SMILES COc1ccc(cc1OC)c1nc(nc(c1)C(F)(F)F)S(=O)(=O)CCCC(=O)N1CCCc2c1cccc2
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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 C26H26F3N3O5S MW 549.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26F3N3O5S/c1-36-21-12-11-18(15-22(21)37-2)19-16-23(26(27,28)29)31-25(30-19)38(34,35)14-6-10-24(33)32-13-5-8-17-7-3-4-9-20(17)32/h3-4,7,9,11-12,15-16H,5-6,8,10,13-14H2,1-2H3InChIKey
VPBNNKNKJSYSDE-UHFFFAOYSA-NSynonyms
685527-24-61(34DIHYDRO2HQUINOLIN1YL)4(4(34DIMETHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFONYLBUTAN1ONE
1(34dihydroquinolin1(2H)yl)4((4(34dimethoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonyl)butan1one
685527246
COC1=C(C=C(C=C1)C2=CC(=NC(=N2)S(=O)(=O)CCCC(=O)N3CCCC4=CC=CC=C43)C(F)(F)F)OC
InChI=1SC26H26F3N3O5Sc13621121118(1522(21)372)191623(26(2728)29)3125(3019)38(3435)1461024(33)32135817734920(17)32h347911121516H568101314H212H3
MFCD06164189
ZINC000001071061
ZINC1071061
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