Vitas-M small molecule compound

2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(2-methylpropyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Catalog ID
STK725868
SMILES N#Cc1c(SCC(=O)c2ccc(cc2)OC)nc2c(c1CC(C)C)CCCC2

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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 C23H26N2O2S MW 394.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O2S/c1-15(2)12-19-18-6-4-5-7-21(18)25-23(20(19)13-24)28-14-22(26)16-8-10-17(27-3)11-9-16/h8-11,15H,4-7,12,14H2,1-3H3
InChIKey
USCXXYDQEPBHLK-UHFFFAOYSA-N
Synonyms
328540-23-4
2((2(4methoxyphenyl)2oxoethyl)sulfanyl)4(2methylpropyl)5678tetrahydroquinoline3carbonitrile
2(2(4methoxyphenyl)2oxoethyl)sulfanyl4(2methylpropyl)5678tetrahydroquinoline3carbonitrile
328540234
CC(C)CC1=C(C(=NC2=C1CCCC2)SCC(=O)C3=CC=C(C=C3)OC)C#N
InChI=1SC23H26N2O2Sc115(2)121918645721(18)2523(20(19)1324)281422(26)1681017(273)11916h81115H471214H213H3
MFCD01578844
ZINC000000841868
ZINC00841868
ZINC841868

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Available files

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