Vitas-M small molecule compound

1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-[(4-methylpyrimidin-2-yl)sulfanyl]ethanone

Catalog ID
STK075356
SMILES Clc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)CSc1nccc(n1)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 C25H26ClN3OS MW 452.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN3OS/c1-17-13-14-27-23(28-17)31-15-22(30)29-21-8-6-5-7-20(21)25(4,16-24(29,2)3)18-9-11-19(26)12-10-18/h5-14H,15-16H2,1-4H3
InChIKey
FXUZVGHFFHHSPP-UHFFFAOYSA-N
Synonyms
352660-16-3
1((4R)4(4CHLOROPHENYL)224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)2((4METHYLPYRIMIDIN2YL)SULFANYL)ETHANONE
1(4(4CHLOROPHENYL)224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)2((4METHYLPYRIMIDIN2YL)SULFANYL)ETHANONE
1(4(4chlorophenyl)224trimethyl34dihydroquinolin1(2H)yl)2((4methylpyrimidin2yl)thio)ethanone
1(4(4CHLOROPHENYL)224TRIMETHYL3HQUINOLIN1YL)2(4METHYLPYRIMIDIN2YL)SULFANYLETHANONE
352660163
CC1=NC(=NC=C1)SCC(=O)N2C3=CC=CC=C3C(CC2(C)C)(C)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)CSc1nccc(n1)C
InChI=1SC25H26ClN3OSc11713142723(2817)311522(30)2921865720(21)25(41624(292)3)1891119(26)121018h514H1516H214H3
MFCD01945300
STK075356
ZINC000001103163
ZINC000001103164

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Available files

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