Vitas-M small molecule compound
2-hydroxy-1-(4-methoxyphenyl)-1'-methyl-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H)-dione
Catalog ID
STK601954
SMILES COc1ccc(cc1)N1C(=NC(=O)C2(C1=O)CN(C)c1c(C2)cc(cc1)[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 C20H18N4O6 MW 410.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O6/c1-22-11-20(10-12-9-14(24(28)29)5-8-16(12)22)17(25)21-19(27)23(18(20)26)13-3-6-15(30-2)7-4-13/h3-9H,10-11H2,1-2H3,(H,21,25,27)InChIKey
KQYTXCUHZCDCLQ-UHFFFAOYSA-NSynonyms
704878-00-21(4methoxyphenyl)1methyl6nitrospiro(13diazinane5324dihydroquinoline)246trione
2hydroxy1(4methoxyphenyl)1methyl6nitro14dihydro2H4Hspiro(pyrimidine53quinoline)46(1H)dione
704878002
CN1CC2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)NC(=O)N(C2=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1C(=NC(=O)C2(C1=O)CN(C)c1c(C2)cc(cc1)(N+)(=O)(O))O
InChI=1SC20H18N4O6c1221120(1012914(24(28)29)5816(12)22)17(25)2119(27)23(18(20)26)133615(302)7413h39H1011H212H3(H212527)
MFCD18158601
ZINC000008995662
ZINC000008995663
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