Vitas-M small molecule compound

3-benzyl-1-[2-(dimethylamino)ethyl]-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione

Catalog ID
STK582024
SMILES CN(CCn1c2sc3c(c2c(=O)n(c1=O)Cc1ccccc1)CCCCC3)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 C22H27N3O2S MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O2S/c1-23(2)13-14-24-21-19(17-11-7-4-8-12-18(17)28-21)20(26)25(22(24)27)15-16-9-5-3-6-10-16/h3,5-6,9-10H,4,7-8,11-15H2,1-2H3
InChIKey
BUGXPCGONQOKDI-UHFFFAOYSA-N
Synonyms
900294-10-2
3benzyl1(2(dimethylamino)ethyl)156789hexahydro2Hcyclohepta(45)thieno(23d)pyrimidine24(3H)dione
3benzyl1(2(dimethylamino)ethyl)6789tetrahydro1Hcyclohepta(45)thieno(23d)pyrimidine24(3H5H)dione
3benzyl1(2(dimethylamino)ethyl)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidine24dione
900294102
CN(C)CCN1C2=C(C3=C(S2)CCCCC3)C(=O)N(C1=O)CC4=CC=CC=C4
InChI=1SC22H27N3O2Sc123(2)1314242119(17117481218(17)2821)20(26)25(22(24)27)151695361016h356910H4781115H212H3
MFCD06612881
ZINC000002360029
ZINC2360029

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Available files

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