Vitas-M small molecule compound

6-(4-tert-butylphenyl)-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile

Catalog ID
STL170529
SMILES COc1ccc(cc1)C(=O)CSc1nc(cc(c1C#N)c1ccccc1)c1ccc(cc1)C(C)(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 C31H28N2O2S MW 492.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O2S/c1-31(2,3)24-14-10-22(11-15-24)28-18-26(21-8-6-5-7-9-21)27(19-32)30(33-28)36-20-29(34)23-12-16-25(35-4)17-13-23/h5-18H,20H2,1-4H3
InChIKey
IKKNTQCMSBBUJG-UHFFFAOYSA-N
Synonyms
362499-01-2
362499012
6(4(TERTBUTYL)PHENYL)2(2(4METHOXYPHENYL)2OXOETHYLTHIO)4PHENYLPYRIDINE3CARBONITRILE
6(4tertbutylphenyl)2((2(4methoxyphenyl)2oxoethyl)sulfanyl)4phenylpyridine3carbonitrile
6(4TERTBUTYLPHENYL)2(2(4METHOXYPHENYL)2OXOETHYL)SULFANYL4PHENYLPYRIDINE3CARBONITRILE
CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)C4=CC=C(C=C4)OC
InChI=1SC31H28N2O2Sc131(23)24141022(111524)281826(218657921)27(1932)30(3328)362029(34)23121625(354)171323h518H20H214H3
MFCD01450606
ZINC000008780940
ZINC08780940
ZINC8780940

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Available files

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