Vitas-M small molecule compound

2-[(4-tert-butylbenzyl)sulfanyl]-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridine-3-carbonitrile

Catalog ID
STK748636
SMILES N#Cc1c(SCc2ccc(cc2)C(C)(C)C)nc(cc1c1ccc(cc1)F)c1cccs1

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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 C27H23FN2S2 MW 458.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN2S2/c1-27(2,3)20-10-6-18(7-11-20)17-32-26-23(16-29)22(19-8-12-21(28)13-9-19)15-24(30-26)25-5-4-14-31-25/h4-15H,17H2,1-3H3
InChIKey
MIQDSIDXIBKRGW-UHFFFAOYSA-N
Synonyms

2((4(TERTBUTYL)PHENYL)METHYLTHIO)4(4FLUOROPHENYL)6(2THIENYL)PYRIDINE3CARBONITRILE
2((4tertbutylbenzyl)sulfanyl)4(4fluorophenyl)6(thiophen2yl)pyridine3carbonitrile
2((4TERTBUTYLBENZYL)SULFANYL)4(4FLUOROPHENYL)6THIOPHEN2YLPYRIDINE3CARBONITRILE
2((4TERTBUTYLPHENYL)METHYLSULFANYL)4(4FLUOROPHENYL)6THIOPHEN2YLPYRIDINE3CARBONITRILE
CC(C)(C)C1=CC=C(C=C1)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=C(C=C4)F)C#N
InChI=1SC27H23FN2S2c127(23)2010618(71120)17322623(1629)22(1981221(28)13919)1524(3026)2554143125h415H17H213H3
MFCD00743621
ZINC000008863657
ZINC08863657
ZINC8863657

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.