Vitas-M small molecule compound
1-(5-chloro-2-methylphenyl)-2'-ethyl-6'-nitro-1'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Catalog ID
STK578436
SMILES CCCN1c2ccc(cc2CC2(C1CC)C(=O)NC(=O)N(C2=O)c1cc(Cl)ccc1C)[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 C24H25ClN4O5 MW 484.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN4O5/c1-4-10-27-18-9-8-17(29(33)34)11-15(18)13-24(20(27)5-2)21(30)26-23(32)28(22(24)31)19-12-16(25)7-6-14(19)3/h6-9,11-12,20H,4-5,10,13H2,1-3H3,(H,26,30,32)InChIKey
QPSPXPBDNQUPDE-UHFFFAOYSA-NSynonyms
879567-47-21(5chloro2methylphenyl)2ethyl6nitro1propyl14dihydro2H2Hspiro(pyrimidine53quinoline)246(1H3H)trione
1(5chloro2methylphenyl)2ethyl6nitro1propyl24dihydro1H1Hspiro(pyrimidine53quinoline)246(3H)trione
1(5chloro2methylphenyl)2ethyl6nitro1propylspiro(13diazinane5324dihydroquinoline)246trione
879567472
CCCN1C(C2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)NC(=O)N(C2=O)C4=C(C=CC(=C4)Cl)C)CC
CCCN1c2ccc(cc2CC2(C1CC)C(=O)NC(=O)N(C2=O)c1cc(Cl)ccc1C)(N+)(=O)(O)
InChI=1SC24H25ClN4O5c141027189817(29(33)34)1115(18)1324(20(27)52)21(30)2623(32)28(22(24)31)191216(25)7614(19)3h69111220H451013H213H3(H263032)
MFCD07638433
ZINC000009433954
ZINC000245327764
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