Vitas-M small molecule compound
1,3-dimethyl-6-[2-(methylamino)-5-nitrophenyl]-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Catalog ID
STK874032
SMILES CNc1ccc(cc1n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C)[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 C21H19N5O4 MW 405.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O4/c1-22-15-10-9-14(26(29)30)11-16(15)25-12-17-18(19(25)13-7-5-4-6-8-13)20(27)24(3)21(28)23(17)2/h4-12,22H,1-3H3InChIKey
ZLFUOINEVKHWAN-UHFFFAOYSA-NSynonyms
700350-11-413dimethyl6(2(methylamino)5nitrophenyl)5phenyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
13DIMETHYL6(2(METHYLAMINO)5NITROPHENYL)5PHENYLPYRROLO(34D)PYRIMIDINE24DIONE
6(5NITRO2(METHYLAMINO)PHENYL)13DIMETHYL5PHENYL1HPYRROLO(34D)PYRIMIDINE24(3H6H)DIONE
700350114
CNC1=C(C=C(C=C1)(N+)(=O)(O))N2C=C3C(=C2C4=CC=CC=C4)C(=O)N(C(=O)N3C)C
CNc1ccc(cc1n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C)(N+)(=O)(O)
InChI=1SC21H19N5O4c1221510914(26(29)30)1116(15)25121718(19(25)137546813)20(27)24(3)21(28)23(17)2h41222H13H3
MFCD03667582
ZINC000004995324
ZINC04995324
ZINC4995324
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