Vitas-M small molecule compound
2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Catalog ID
STK093786
SMILES O=C(N1c2ccccc2C(CC1(C)C)(C)c1ccccc1)CSc1nc2c(s1)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 C27H26N2OS2 MW 458.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2OS2/c1-26(2)18-27(3,19-11-5-4-6-12-19)20-13-7-9-15-22(20)29(26)24(30)17-31-25-28-21-14-8-10-16-23(21)32-25/h4-16H,17-18H2,1-3H3InChIKey
MSPKGDQFHJLSQO-UHFFFAOYSA-NSynonyms
298204-27-02(13BENZOTHIAZOL2YLSULFANYL)1(224TRIMETHYL4PHENYL34DIHYDROQUINOLIN1(2H)YL)ETHANONE
2(13BENZOTHIAZOL2YLSULFANYL)1(224TRIMETHYL4PHENYL3HQUINOLIN1YL)ETHANONE
2(benzo(d)thiazol2ylthio)1(224trimethyl4phenyl34dihydroquinolin1(2H)yl)ethanone
298204270
CC1(CC(C2=CC=CC=C2N1C(=O)CSC3=NC4=CC=CC=C4S3)(C)C5=CC=CC=C5)C
InChI=1SC27H26N2OS2c126(2)1827(319115461219)2013791522(20)29(26)24(30)1731252821148101623(21)3225h416H1718H213H3
MFCD01079459
O=C(N1c2ccccc2C(CC1(C)C)(C)c1ccccc1)CSc1nc2c(s1)cccc2
STK093786
ZINC000001832980
ZINC000001832981
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