Vitas-M small molecule compound
2,6-di-tert-butyl-4-[(2-sulfanylphenyl)imino]cyclohexa-2,5-dien-1-one
Catalog ID
STK536016
SMILES O=C1C(=C/C(=N/c2ccccc2S)/C=C1C(C)(C)C)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 C20H25NOS MW 327.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NOS/c1-19(2,3)14-11-13(12-15(18(14)22)20(4,5)6)21-16-9-7-8-10-17(16)23/h7-12,23H,1-6H3InChIKey
GCQMTPRTHQSYBD-UHFFFAOYSA-NSynonyms
26ditertbutyl4((2mercaptophenyl)imino)cyclohexa25dienone
26ditertbutyl4((2sulfanylphenyl)imino)cyclohexa25dien1one
26DITERTBUTYL4(2SULFANYLPHENYL)IMINOCYCLOHEXA25DIEN1ONE
CC(C)(C)C1=CC(=NC2=CC=CC=C2S)C=C(C1=O)C(C)(C)C
InChI=1SC20H25NOSc119(23)141113(1215(18(14)22)20(45)6)21169781017(16)23h71223H16H3
MFCD02163824
O=C1C(=CC(=Nc2ccccc2S)C=C1C(C)(C)C)C(C)(C)C
ZINC000004834302
ZINC4834302
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