Vitas-M small molecule compound
3-(benzylsulfanyl)-2-[(4,6-dimethylpyrimidin-2-yl)oxy]-3,3-diphenylpropanoic acid
Catalog ID
STK013010
SMILES OC(=O)C(C(c1ccccc1)(c1ccccc1)SCc1ccccc1)Oc1nc(C)cc(n1)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 C28H26N2O3S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O3S/c1-20-18-21(2)30-27(29-20)33-25(26(31)32)28(23-14-8-4-9-15-23,24-16-10-5-11-17-24)34-19-22-12-6-3-7-13-22/h3-18,25H,19H2,1-2H3,(H,31,32)InChIKey
KQAAWCWFVLUBPF-UHFFFAOYSA-NSynonyms
3(BENZYLSULFANYL)2((46DIMETHYLPYRIMIDIN2YL)OXY)33DIPHENYLPROPANOICACID
3BENZYLSULFANYL2(46DIMETHYLPYRIMIDIN2YL)OXY33DIPHENYLPROPANOICACID
CC1=CC(=NC(=N1)OC(C(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC4=CC=CC=C4)C
InChI=1SC28H26N2O3Sc1201821(2)3027(2920)3325(26(31)32)28(231484915232416105111724)341922126371322h31825H19H212H3(H3132)
MFCD08049489
OC(=O)C(C(c1ccccc1)(c1ccccc1)SCc1ccccc1)Oc1nc(C)cc(n1)C
STK013010
ZINC000013940004
ZINC000013940005
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