Vitas-M small molecule compound
2-{[3-(dimethylamino)propyl]amino}-3-(4-methoxyphenyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK578836
SMILES COc1ccc(cc1)n1c(NCCCN(C)C)nc2c(c1=O)c1CCCCCc1s2
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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 C23H30N4O2S MW 426.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O2S/c1-26(2)15-7-14-24-23-25-21-20(18-8-5-4-6-9-19(18)30-21)22(28)27(23)16-10-12-17(29-3)13-11-16/h10-13H,4-9,14-15H2,1-3H3,(H,24,25)InChIKey
PGUTZPHFDGFHHF-UHFFFAOYSA-NSynonyms
896845-27-52((3(dimethylamino)propyl)amino)3(4methoxyphenyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2((3(dimethylamino)propyl)amino)3(4methoxyphenyl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
2(3(dimethylamino)propylamino)3(4methoxyphenyl)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
896845275
CN(C)CCCNC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC23H30N4O2Sc126(2)157142423252120(188546919(18)3021)22(28)27(23)16101217(293)131116h1013H491415H213H3(H2425)
MFCD06601951
ZINC000002230419
ZINC2230419
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