Vitas-M small molecule compound
4,4'-(1,3-benzodioxol-5-ylmethanediyl)bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one)
Catalog ID
STK760944
SMILES CC1=NN(C(=O)C1C(C1C(=NN(C1=O)c1ccccc1)C)c1ccc2c(c1)OCO2)c1ccccc1
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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 C28H24N4O4 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O4/c1-17-24(27(33)31(29-17)20-9-5-3-6-10-20)26(19-13-14-22-23(15-19)36-16-35-22)25-18(2)30-32(28(25)34)21-11-7-4-8-12-21/h3-15,24-26H,16H2,1-2H3InChIKey
NUCQLNBXDZQCDU-UHFFFAOYSA-NSynonyms
296890-92-1296890921
4(13BENZODIOXOL5YL(3METHYL5OXO1PHENYL4HPYRAZOL4YL)METHYL)5METHYL2PHENYL4HPYRAZOL3ONE
44(13benzodioxol5ylmethanediyl)bis(5methyl2phenyl24dihydro3Hpyrazol3one)
44(benzo(d)(13)dioxol5ylmethylene)bis(3methyl1phenyl1Hpyrazol5(4H)one)
CC1=NN(C(=O)C1C(C2C(=NN(C2=O)C3=CC=CC=C3)C)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6
InChI=1SC28H24N4O4c11724(27(33)31(2917)2095361020)26(1913142223(1519)36163522)2518(2)3032(28(25)34)21117481221h3152426H16H212H3
MFCD01806326
ZINC000100081921
ZINC000248037470
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