Vitas-M small molecule compound
7-benzyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(3-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK932996
SMILES Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1
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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 C31H26BrN3O2S2 MW 616.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26BrN3O2S2/c1-20-6-5-9-24(16-20)35-30(37)28-25-14-15-34(17-21-7-3-2-4-8-21)18-27(25)39-29(28)33-31(35)38-19-26(36)22-10-12-23(32)13-11-22/h2-13,16H,14-15,17-19H2,1H3InChIKey
CPJUMENFWBWBLK-UHFFFAOYSA-NSynonyms
7benzyl2((2(4bromophenyl)2oxoethyl)sulfanyl)3(3methylphenyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2((2(4bromophenyl)2oxoethyl)thio)3(mtolyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2(2(4bromophenyl)2oxoethyl)sulfanyl3(3methylphenyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=C(C=C4)Br)SC5=C3CCN(C5)CC6=CC=CC=C6
InChI=1SC31H26BrN3O2S2c12065924(1620)3530(37)2825141534(17217324821)1827(25)3929(28)3331(35)381926(36)22101223(32)131122h21316H14151719H21H3
MFCD03294430
ZINC000102833422
ZINC102833422
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