Vitas-M small molecule compound
2-(4-methylpiperazin-1-yl)-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK598408
SMILES CN1CCN(CC1)c1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3
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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 C22H26N4OS MW 394.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4OS/c1-24-12-14-25(15-13-24)22-23-20-19(17-10-6-3-7-11-18(17)28-20)21(27)26(22)16-8-4-2-5-9-16/h2,4-5,8-9H,3,6-7,10-15H2,1H3InChIKey
XZIWTTHWQOFAHP-UHFFFAOYSA-NSynonyms
896071-81-12(4methylpiperazin1yl)3phenyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2(4methylpiperazin1yl)3phenyl6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
2(4methylpiperazin1yl)3phenyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
896071811
CN1CCN(CC1)C2=NC3=C(C4=C(S3)CCCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC22H26N4OSc124121425(151324)22232019(17106371118(17)2820)21(27)26(22)168425916h24589H3671015H21H3
MFCD06591756
ZINC000002433755
ZINC2433755
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