Vitas-M small molecule compound
1'-butyl-6-hydroxy-6'-nitro-3-(prop-2-en-1-yl)-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Catalog ID
STK588381
SMILES CCCC1N(CCCC)c2ccc(cc2CC21C(=NC(=O)N(C2=O)CC=C)O)[N+](=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 C22H28N4O5 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5/c1-4-7-12-24-17-10-9-16(26(30)31)13-15(17)14-22(18(24)8-5-2)19(27)23-21(29)25(11-6-3)20(22)28/h6,9-10,13,18H,3-5,7-8,11-12,14H2,1-2H3,(H,23,27,29)InChIKey
IXRXHULXHKRONE-UHFFFAOYSA-NSynonyms
879449-72-6879449726
CCCC1N(CCCC)c2ccc(cc2CC21C(=NC(=O)N(C2=O)CC=C)O)(N+)(=O)(O)
MFCD07203391
ZINC000009240861
ZINC000105801265
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Check stock on Vitas-MAvailable files
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