Vitas-M small molecule compound
2,8,8-trimethyl-5-(4-nitrophenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK981232
SMILES Cc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(cc1)[N+](=O)[O-])C(=O)CC(C3)(C)C
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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 C20H20N4O4 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4/c1-10-21-18-17(19(26)22-10)15(11-4-6-12(7-5-11)24(27)28)16-13(23-18)8-20(2,3)9-14(16)25/h4-7,15H,8-9H2,1-3H3,(H2,21,22,23,26)InChIKey
NWCABWFYSOZQRB-UHFFFAOYSA-NSynonyms
288trimethyl5(4nitrophenyl)57910tetrahydro1Hpyrimido(45b)quinoline46dione
288trimethyl5(4nitrophenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
CC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=C(C=C4)(N+)(=O)(O))C(=O)CC(C3)(C)C
Cc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccc(cc1)(N+)(=O)(O))C(=O)CC(C3)(C)C
InChI=1SC20H20N4O4c110211817(19(26)2210)15(114612(7511)24(27)28)1613(2318)820(23)914(16)25h4715H89H213H3(H221222326)
MFCD18181290
ZINC000044974074
ZINC000044974079
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