Vitas-M small molecule compound
2-[(4-amino-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-1-(4-bromophenyl)ethanone
Catalog ID
STK830735
SMILES Brc1ccc(cc1)C(=O)CSc1nc(N)c2c(n1)sc1c2CCCCC1
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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 C19H18BrN3OS2 MW 448.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN3OS2/c20-12-8-6-11(7-9-12)14(24)10-25-19-22-17(21)16-13-4-2-1-3-5-15(13)26-18(16)23-19/h6-9H,1-5,10H2,(H2,21,22,23)InChIKey
YAFFTLWDDZERDK-UHFFFAOYSA-NSynonyms
373617-89-12((4amino6789tetrahydro5Hcyclohepta(45)thieno(12c)pyrimidin2yl)sulfanyl)1(4bromophenyl)ethanone
2((4amino6789tetrahydro5Hcyclohepta(45)thieno(23d)pyrimidin2yl)sulfanyl)1(4bromophenyl)ethanone
2((4amino6789tetrahydro5Hcyclohepta(45)thieno(23d)pyrimidin2yl)thio)1(4bromophenyl)ethanone
373617891
C1CCC2=C(CC1)SC3=NC(=NC(=C23)N)SCC(=O)C4=CC=C(C=C4)Br
InChI=1SC19H18BrN3OS2c20128611(7912)14(24)1025192217(21)16134213515(13)2618(16)2319h69H1510H2(H2212223)
MFCD01949085
ZINC000001176919
ZINC01176919
ZINC1176919
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