Vitas-M small molecule compound
2-{3,5,6-trichloro-4-[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]pyridin-2-yl}-N-[4-(trifluoromethyl)phenyl]hydrazinecarbothioamide
Catalog ID
STK678308
SMILES S=C(Nc1ccc(cc1)C(F)(F)F)NNc1nc(Cl)c(c(c1Cl)Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cl
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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 C27H28Cl3F3N4OS2 MW 652.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28Cl3F3N4OS2/c1-25(2,3)16-11-15(12-17(20(16)38)26(4,5)6)40-21-18(28)22(30)35-23(19(21)29)36-37-24(39)34-14-9-7-13(8-10-14)27(31,32)33/h7-12,38H,1-6H3,(H,35,36)(H2,34,37,39)InChIKey
IDKBKKSYPNXFEB-UHFFFAOYSA-NSynonyms
1((356TRICHLORO4(35DITERTBUTYL4HYDROXYPHENYL)SULFANYLPYRIDIN2YL)AMINO)3(4(TRIFLUOROMETHYL)PHENYL)THIOUREA
2(356trichloro4((35ditertbutyl4hydroxyphenyl)sulfanyl)pyridin2yl)N(4(trifluoromethyl)phenyl)hydrazinecarbothioamide
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=C(C(=NC(=C2Cl)Cl)NNC(=S)NC3=CC=C(C=C3)C(F)(F)F)Cl
InChI=1SC27H28Cl3F3N4OS2c125(23)161115(1217(20(16)38)26(45)6)402118(28)22(30)3523(19(21)29)363724(39)34149713(81014)27(3132)33h71238H16H3(H3536)(H2343739)
MFCD03034460
ZINC000033354745
ZINC33354745
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