Vitas-M small molecule compound
7-benzyl-2-[(4-methoxybenzyl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL026300
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)OC)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 C31H29N3O3S2 MW 555.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S2/c1-36-24-12-8-22(9-13-24)20-38-31-32-29-28(30(35)34(31)23-10-14-25(37-2)15-11-23)26-16-17-33(19-27(26)39-29)18-21-6-4-3-5-7-21/h3-15H,16-20H2,1-2H3InChIKey
FXBAZEBTVNSWLW-UHFFFAOYSA-NSynonyms
7benzyl2((4methoxybenzyl)sulfanyl)3(4methoxyphenyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2((4methoxybenzyl)thio)3(4methoxyphenyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3(4methoxyphenyl)2((4methoxyphenyl)methylsulfanyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
COC1=CC=C(C=C1)CSC2=NC3=C(C4=C(S3)CN(CC4)CC5=CC=CC=C5)C(=O)N2C6=CC=C(C=C6)OC
InChI=1SC31H29N3O3S2c1362412822(91324)203831322928(30(35)34(31)23101425(372)151123)26161733(1927(26)3929)18216435721h315H1620H212H3
MFCD01854914
ZINC000053336456
ZINC53336456
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