Vitas-M small molecule compound
1,3-dimethyl-6-[2-(methylamino)-5-nitrophenyl]-5-(4-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Catalog ID
STL071296
SMILES CNc1ccc(cc1n1cc2c(c1c1ccc(cc1)C)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 C22H21N5O4 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4/c1-13-5-7-14(8-6-13)20-19-18(24(3)22(29)25(4)21(19)28)12-26(20)17-11-15(27(30)31)9-10-16(17)23-2/h5-12,23H,1-4H3InChIKey
QGMQWKNUDGOVFG-UHFFFAOYSA-NSynonyms
573695-39-313dimethyl6(2(methylamino)5nitrophenyl)5(4methylphenyl)1Hpyrrolo(34d)pyrimidine24(3H6H)dione
13DIMETHYL6(2(METHYLAMINO)5NITROPHENYL)5(4METHYLPHENYL)PYRROLO(34D)PYRIMIDINE24DIONE
13dimethyl6(2(methylamino)5nitrophenyl)5(ptolyl)1Hpyrrolo(34d)pyrimidine24(3H6H)dione
573695393
CC1=CC=C(C=C1)C2=C3C(=CN2C4=C(C=CC(=C4)(N+)(=O)(O))NC)N(C(=O)N(C3=O)C)C
CNc1ccc(cc1n1cc2c(c1c1ccc(cc1)C)c(=O)n(c(=O)n2C)C)(N+)(=O)(O)
InChI=1SC22H21N5O4c1135714(8613)201918(24(3)22(29)25(4)21(19)28)1226(20)171115(27(30)31)91016(17)232h51223H14H3
MFCD04017637
ZINC000004151186
ZINC04151186
ZINC4151186
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