Vitas-M small molecule compound
4-oxo-4-[4-(4-oxo-3-propyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)piperazin-1-yl]butanoic acid
Catalog ID
STK631445
SMILES CCCn1c(nc2c(c1=O)c1CCCCc1s2)N1CCN(CC1)C(=O)CCC(=O)O
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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 C21H28N4O4S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O4S/c1-2-9-25-20(29)18-14-5-3-4-6-15(14)30-19(18)22-21(25)24-12-10-23(11-13-24)16(26)7-8-17(27)28/h2-13H2,1H3,(H,27,28)InChIKey
XQNVFNHYEOQPHU-UHFFFAOYSA-NSynonyms
1018052-86-21018052862
4oxo4(4(4oxo3propyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)piperazin1yl)butanoicacid
4oxo4(4(4oxo3propyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)piperazin1yl)butanoicacid
4oxo4(4(4oxo3propyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)piperazin1yl)butanoicacid
CCCN1C(=O)C2=C(N=C1N3CCN(CC3)C(=O)CCC(=O)O)SC4=C2CCCC4
InChI=1SC21H28N4O4Sc1292520(29)1814534615(14)3019(18)2221(25)24121023(111324)16(26)7817(27)28h213H21H3(H2728)
MFCD12205640
ZINC000020717108
ZINC20717108
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