Vitas-M small molecule compound

7-benzyl-2-[(4-chlorobenzyl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK526373
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)Cl)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 C30H26ClN3O2S2 MW 560.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3O2S2/c1-36-24-13-11-23(12-14-24)34-29(35)27-25-15-16-33(17-20-5-3-2-4-6-20)18-26(25)38-28(27)32-30(34)37-19-21-7-9-22(31)10-8-21/h2-14H,15-19H2,1H3
InChIKey
YAAREAGBUWOFLB-UHFFFAOYSA-N
Synonyms

7benzyl2((4chlorobenzyl)sulfanyl)3(4methoxyphenyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2((4chlorobenzyl)thio)3(4methoxyphenyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2((4chlorophenyl)methylsulfanyl)3(4methoxyphenyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=C(C=C4)Cl)SC5=C3CCN(C5)CC6=CC=CC=C6
InChI=1SC30H26ClN3O2S2c13624131123(121424)3429(35)2725151633(17205324620)1826(25)3828(27)3230(34)3719217922(31)10821h214H1519H21H3
MFCD01953834
ZINC000002604180
ZINC2604180

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Available files

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