Vitas-M small molecule compound
3-[1-methyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]benzoic acid
Catalog ID
STK784104
SMILES O=C1NC(c2cccc(c2)[N+](=O)[O-])C2=C(N1C)CN(C2=O)c1cccc(c1)C(=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 C20H16N4O6 MW 408.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O6/c1-22-15-10-23(13-6-3-5-12(9-13)19(26)27)18(25)16(15)17(21-20(22)28)11-4-2-7-14(8-11)24(29)30/h2-9,17H,10H2,1H3,(H,21,28)(H,26,27)InChIKey
LHHZWKFKFBTFDQ-UHFFFAOYSA-NSynonyms
879436-53-03(1methyl4(3nitrophenyl)25dioxo123457hexahydro6Hpyrrolo(34d)pyrimidin6yl)benzoicacid
3(1methyl4(3nitrophenyl)25dioxo34dihydro1Hpyrrolo(34d)pyrimidin6(2H5H7H)yl)benzoicacid
3(1METHYL4(3NITROPHENYL)25DIOXO47DIHYDRO3HPYRROLO(34D)PYRIMIDIN6YL)BENZOICACID
879436530
CN1C2=C(C(NC1=O)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)N(C2)C4=CC=CC(=C4)C(=O)O
InChI=1SC20H16N4O6c122151023(1363512(913)19(26)27)18(25)16(15)17(2120(22)28)1142714(811)24(29)30h2917H10H21H3(H2128)(H2627)
MFCD06619444
O=C1NC(c2cccc(c2)(N+)(=O)(O))C2=C(N1C)CN(C2=O)c1cccc(c1)C(=O)O
ZINC000004753693
ZINC000004753694
Check stock
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