Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-methyl-6-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Catalog ID
STK786082
SMILES COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)[N+](=O)[O-])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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c1-22-16-11-23(13-4-3-5-14(10-13)24(27)28)19(25)17(16)18(21-20(22)26)12-6-8-15(29-2)9-7-12/h3-10,18H,11H2,1-2H3,(H,21,26)InChIKey
ABMVSCUNHDTQIG-UHFFFAOYSA-NSynonyms
893781-72-14(4methoxyphenyl)1methyl6(3nitrophenyl)3467tetrahydro1Hpyrrolo(34d)pyrimidine25dione
4(4methoxyphenyl)1methyl6(3nitrophenyl)47dihydro3Hpyrrolo(34d)pyrimidine25dione
893781721
CN1C2=C(C(NC1=O)C3=CC=C(C=C3)OC)C(=O)N(C2)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)(N+)(=O)(O))C
InChI=1SC20H18N4O5c122161123(1343514(1013)24(27)28)19(25)17(16)18(2120(22)26)126815(292)9712h31018H11H212H3(H2126)
MFCD08142573
ZINC000006668408
ZINC000006668409
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