Vitas-M small molecule compound
3-(3-chlorophenyl)-2-(4-methylpiperazin-1-yl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK578736
SMILES CN1CCN(CC1)c1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)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 C22H25ClN4OS MW 428.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN4OS/c1-25-10-12-26(13-11-25)22-24-20-19(17-8-3-2-4-9-18(17)29-20)21(28)27(22)16-7-5-6-15(23)14-16/h5-7,14H,2-4,8-13H2,1H3InChIKey
VDIMMEVBBBXUAF-UHFFFAOYSA-NSynonyms
896830-19-63(3chlorophenyl)2(4methylpiperazin1yl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(3chlorophenyl)2(4methylpiperazin1yl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(3chlorophenyl)2(4methylpiperazin1yl)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
896830196
CN1CCN(CC1)C2=NC3=C(C4=C(S3)CCCCC4)C(=O)N2C5=CC(=CC=C5)Cl
InChI=1SC22H25ClN4OSc125101226(131125)22242019(178324918(17)2920)21(28)27(22)1675615(23)1416h5714H24813H21H3
MFCD06599528
ZINC000002219106
ZINC2219106
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