Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK542001
SMILES Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)C(C)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 C28H27BrN2O3S2 MW 583.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27BrN2O3S2/c1-17(2)23-14-21-24(15-34-23)36-26-25(21)27(33)31(13-12-18-6-4-3-5-7-18)28(30-26)35-16-22(32)19-8-10-20(29)11-9-19/h3-11,17,23H,12-16H2,1-2H3InChIKey
AJHDTJJIDXQOOC-UHFFFAOYSA-NSynonyms
2((2(4bromophenyl)2oxoethyl)sulfanyl)3(2phenylethyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2(4bromophenyl)2oxoethyl)thio)6isopropyl3phenethyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2(2(4bromophenyl)2oxoethyl)sulfanyl3(2phenylethyl)6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin4one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=C(C=C4)Br)CCC5=CC=CC=C5
InChI=1SC28H27BrN2O3S2c117(2)23142124(153423)362625(21)27(33)31(1312186435718)28(3026)351622(32)1981020(29)11919h3111723H1216H212H3
MFCD03286286
ZINC000001824932
ZINC000001824933
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