Vitas-M small molecule compound
2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Catalog ID
STK053183
SMILES O=C(N1c2ccccc2C(CC1(C)C)(C)c1ccccc1)CSc1nc(C)cc(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 C26H29N3OS MW 431.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3OS/c1-18-15-19(2)28-24(27-18)31-16-23(30)29-22-14-10-9-13-21(22)26(5,17-25(29,3)4)20-11-7-6-8-12-20/h6-15H,16-17H2,1-5H3InChIKey
AGDSMBGBRNPYCL-UHFFFAOYSA-NSynonyms
2((46DIMETHYLPYRIMIDIN2YL)SULFANYL)1(224TRIMETHYL4PHENYL34DIHYDROQUINOLIN1(2H)YL)ETHANONE
2((46dimethylpyrimidin2yl)thio)1(224trimethyl4phenyl34dihydroquinolin1(2H)yl)ethanone
2(46DIMETHYLPYRIMIDIN2YL)SULFANYL1(224TRIMETHYL4PHENYL3HQUINOLIN1YL)ETHANONE
CC1=CC(=NC(=N1)SCC(=O)N2C3=CC=CC=C3C(CC2(C)C)(C)C4=CC=CC=C4)C
InChI=1SC26H29N3OSc1181519(2)2824(2718)311623(30)2922141091321(22)26(51725(293)4)20117681220h615H1617H215H3
MFCD01975826
O=C(N1c2ccccc2C(CC1(C)C)(C)c1ccccc1)CSc1nc(C)cc(n1)C
STK053183
ZINC000002291009
ZINC000002291010
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