Vitas-M small molecule compound
1-benzyl-3-(4-nitrophenyl)-5-(propan-2-yl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Catalog ID
STL019116
SMILES CC(N1C(=O)C2C(C1=O)N(NC2c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)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 C21H22N4O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4/c1-13(2)24-20(26)17-18(15-8-10-16(11-9-15)25(28)29)22-23(19(17)21(24)27)12-14-6-4-3-5-7-14/h3-11,13,17-19,22H,12H2,1-2H3InChIKey
DUGBMWGIDZFZEO-UHFFFAOYSA-NSynonyms
1005040-07-21005040072
1benzyl3(4nitrophenyl)5(propan2yl)tetrahydropyrrolo(34c)pyrazole46(1H5H)dione
1BENZYL3(4NITROPHENYL)5PROPAN2YL233A6ATETRAHYDROPYRROLO(34C)PYRAZOLE46DIONE
1BENZYL5ISOPROPYL3(4NITROPHENYL)TETRAHYDROPYRROLO(34C)PYRAZOLE46(2H5H)DIONE
CC(C)N1C(=O)C2C(NN(C2C1=O)CC3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O)
CC(N1C(=O)C2C(C1=O)N(NC2c1ccc(cc1)(N+)(=O)(O))Cc1ccccc1)C
InChI=1SC21H22N4O4c113(2)2420(26)1718(1581016(11915)25(28)29)2223(19(17)21(24)27)12146435714h31113171922H12H212H3
MFCD05718966
ZINC000019169103
ZINC000244947637
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