Vitas-M small molecule compound
2-(1,3-benzoxazol-2-ylsulfanyl)-1-[4-(4-bromophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]ethanone
Catalog ID
STK004416
SMILES Brc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)CSc1nc2c(o1)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 C27H25BrN2O2S MW 521.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O2S/c1-26(2)17-27(3,18-12-14-19(28)15-13-18)20-8-4-6-10-22(20)30(26)24(31)16-33-25-29-21-9-5-7-11-23(21)32-25/h4-15H,16-17H2,1-3H3InChIKey
BXDHYZPNKIAVBM-UHFFFAOYSA-NSynonyms
361991-71-12(13BENZOXAZOL2YLSULFANYL)1((4R)4(4BROMOPHENYL)224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)ETHANONE
2(13BENZOXAZOL2YLSULFANYL)1(4(4BROMOPHENYL)224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)ETHANONE
2(13BENZOXAZOL2YLSULFANYL)1(4(4BROMOPHENYL)224TRIMETHYL3HQUINOLIN1YL)ETHANONE
2(benzo(d)oxazol2ylthio)1(4(4bromophenyl)224trimethyl34dihydroquinolin1(2H)yl)ethanone
361991711
Brc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)CSc1nc2c(o1)cccc2
CC1(CC(C2=CC=CC=C2N1C(=O)CSC3=NC4=CC=CC=C4O3)(C)C5=CC=C(C=C5)Br)C
InChI=1SC27H25BrN2O2Sc126(2)1727(318121419(28)151318)208461022(20)30(26)24(31)16332529219571123(21)3225h415H1617H213H3
MFCD01945339
STK004416
ZINC000001761677
ZINC000001761680
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