Vitas-M small molecule compound
2-({3-cyano-6-[3-methyl-4-(3-methylbutoxy)phenyl]-4-(trifluoromethyl)pyridin-2-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Catalog ID
STK800710
SMILES N#Cc1c(SCC(=O)Nc2cccc(c2)C)nc(cc1C(F)(F)F)c1ccc(c(c1)C)OCCC(C)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 C28H28F3N3O2S MW 527.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28F3N3O2S/c1-17(2)10-11-36-25-9-8-20(13-19(25)4)24-14-23(28(29,30)31)22(15-32)27(34-24)37-16-26(35)33-21-7-5-6-18(3)12-21/h5-9,12-14,17H,10-11,16H2,1-4H3,(H,33,35)InChIKey
UHXZNLWKLNKQPB-UHFFFAOYSA-NSynonyms
2((3cyano6(3methyl4(3methylbutoxy)phenyl)4(trifluoromethyl)pyridin2yl)sulfanyl)N(3methylphenyl)acetamide
2(3cyano6(3methyl4(3methylbutoxy)phenyl)4(trifluoromethyl)pyridin2yl)sulfanylN(3methylphenyl)acetamide
CC1=CC(=CC=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC(=C(C=C3)OCCC(C)C)C)C(F)(F)F)C#N
InChI=1SC28H28F3N3O2Sc117(2)101136259820(1319(25)4)241423(28(2930)31)22(1532)27(3424)371626(35)332175618(3)1221h59121417H101116H214H3(H3335)
MFCD06642937
ZINC000016735903
ZINC16735903
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