Vitas-M small molecule compound
6-hydroxy-1'-methyl-6'-nitro-2'-phenyl-3-(prop-2-en-1-yl)-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Catalog ID
STK586230
SMILES C=CCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[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 C22H20N4O5 MW 420.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O5/c1-3-11-25-20(28)22(19(27)23-21(25)29)13-15-12-16(26(30)31)9-10-17(15)24(2)18(22)14-7-5-4-6-8-14/h3-10,12,18H,1,11,13H2,2H3,(H,23,27,29)InChIKey
GCUUOVJDPBOMMU-UHFFFAOYSA-NSynonyms
879470-85-61methyl6nitro2phenyl1prop2enylspiro(13diazinane5324dihydroquinoline)246trione
6hydroxy1methyl6nitro2phenyl3(prop2en1yl)14dihydro2H2Hspiro(pyrimidine53quinoline)24(3H)dione
879470856
C=CCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)(N+)(=O)(O))O
CN1C(C2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)NC(=O)N(C2=O)CC=C)C4=CC=CC=C4
InChI=1SC22H20N4O5c13112520(28)22(19(27)2321(25)29)13151216(26(30)31)91017(15)24(2)18(22)147546814h3101218H11113H22H3(H232729)
MFCD07207635
ZINC000009448426
ZINC000102777769
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