Vitas-M small molecule compound

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

Catalog ID
STK047001
SMILES CC(CCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)Cc1ccccc1)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 C28H31N3OS2 MW 489.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3OS2/c1-20(2)14-16-33-28-29-26-25(27(32)31(28)18-22-11-7-4-8-12-22)23-13-15-30(19-24(23)34-26)17-21-9-5-3-6-10-21/h3-12,20H,13-19H2,1-2H3
InChIKey
AOIXFGCKIKMZNR-UHFFFAOYSA-N
Synonyms
351008-77-0
351008770
37dibenzyl2((3methylbutyl)sulfanyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
37dibenzyl2(3methylbutylsulfanyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
37dibenzyl2(isopentylthio)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
CC(C)CCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1CC5=CC=CC=C5
CC(CCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)Cc1ccccc1)C
InChI=1SC28H31N3OS2c120(2)14163328292625(27(32)31(28)1822117481222)23131530(1924(23)3426)172195361021h31220H1319H212H3
MFCD01565028
STK047001
ZINC000020827789
ZINC20827789

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Available files

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