Vitas-M small molecule compound
7-benzyl-2-(5-bromo-2-hydroxy-3-methoxyphenyl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384761
SMILES COc1cc(Br)cc(c1O)C1N=C(O)c2c(N1)sc1c2CCN(C1)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 C23H22BrN3O3S MW 500.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3S/c1-30-17-10-14(24)9-16(20(17)28)21-25-22(29)19-15-7-8-27(11-13-5-3-2-4-6-13)12-18(15)31-23(19)26-21/h2-6,9-10,21,26,28H,7-8,11-12H2,1H3,(H,25,29)InChIKey
SCEJAWMXGVMTJH-UHFFFAOYSA-NSynonyms
7benzyl2(5bromo2hydroxy3methoxyphenyl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7benzyl2(5bromo2hydroxy3methoxyphenyl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
COC1=C(C(=CC(=C1)Br)C2NC3=C(C4=C(S3)CN(CC4)CC5=CC=CC=C5)C(=O)N2)O
InChI=1SC23H22BrN3O3Sc130171014(24)916(20(17)28)212522(29)19157827(11135324613)1218(15)3123(19)2621h26910212628H781112H21H3(H2529)
MFCD05661720
ZINC000015947354
ZINC000015947356
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