Vitas-M small molecule compound
6-(3,4-dimethylphenyl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Catalog ID
STK784105
SMILES CN1C(=O)NC(C2=C1CN(C2=O)c1ccc(c(c1)C)C)c1cccc(c1)[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 C21H20N4O4 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4/c1-12-7-8-15(9-13(12)2)24-11-17-18(20(24)26)19(22-21(27)23(17)3)14-5-4-6-16(10-14)25(28)29/h4-10,19H,11H2,1-3H3,(H,22,27)InChIKey
APJWNKOACKAGMG-UHFFFAOYSA-NSynonyms
879474-32-56(34dimethylphenyl)1methyl4(3nitrophenyl)3467tetrahydro1Hpyrrolo(34d)pyrimidine25dione
6(34DIMETHYLPHENYL)1METHYL4(3NITROPHENYL)47DIHYDRO3HPYRROLO(34D)PYRIMIDINE25DIONE
879474325
CC1=C(C=C(C=C1)N2CC3=C(C2=O)C(NC(=O)N3C)C4=CC(=CC=C4)(N+)(=O)(O))C
CN1C(=O)NC(C2=C1CN(C2=O)c1ccc(c(c1)C)C)c1cccc(c1)(N+)(=O)(O)
InChI=1SC21H20N4O4c1127815(913(12)2)24111718(20(24)26)19(2221(27)23(17)3)1454616(1014)25(28)29h41019H11H213H3(H2227)
MFCD06619445
ZINC000004753695
ZINC000004753696
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