Vitas-M small molecule compound

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

Catalog ID
STK054004
SMILES Cc1ccc(c(c1)C)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)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 C32H31N3OS2 MW 537.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3OS2/c1-22-13-14-26(23(2)17-22)21-37-32-33-30-29(31(36)35(32)19-25-11-7-4-8-12-25)27-15-16-34(20-28(27)38-30)18-24-9-5-3-6-10-24/h3-14,17H,15-16,18-21H2,1-2H3
InChIKey
NVOAVTIBOXUYTB-UHFFFAOYSA-N
Synonyms
351008-76-9
351008769
37dibenzyl2((24dimethylbenzyl)sulfanyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
37dibenzyl2((24dimethylbenzyl)thio)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
37dibenzyl2((24dimethylphenyl)methylsulfanyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
CC1=CC(=C(C=C1)CSC2=NC3=C(C4=C(S3)CN(CC4)CC5=CC=CC=C5)C(=O)N2CC6=CC=CC=C6)C
Cc1ccc(c(c1)C)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)Cc1ccccc1
InChI=1SC32H31N3OS2c122131426(23(2)1722)213732333029(31(36)35(32)1925117481225)27151634(2028(27)3830)182495361024h31417H15161821H212H3
MFCD01563444
STK054004
ZINC000097949635
ZINC97949635

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Available files

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