Vitas-M small molecule compound

5-(3-fluorophenyl)-1-{2-[5-(4-methoxyphenyl)-3-(naphthalen-1-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione

Catalog ID
STL176103
SMILES COc1ccc(cc1)C1CC(=NN1C(=O)CN1N=NC2C1C(=O)N(C2=O)c1cccc(c1)F)c1cccc2c1cccc2

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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 C32H25FN6O4 MW 576.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25FN6O4/c1-43-23-14-12-20(13-15-23)27-17-26(25-11-4-7-19-6-2-3-10-24(19)25)35-39(27)28(40)18-37-30-29(34-36-37)31(41)38(32(30)42)22-9-5-8-21(33)16-22/h2-16,27,29-30H,17-18H2,1H3
InChIKey
NRKYFGFNINKMPH-UHFFFAOYSA-N
Synonyms
667406-72-6
5(3FLUOROPHENYL)1(2(5(4METHOXYPHENYL)3(1NAPHTHYL)45DIHYDRO1HPYRAZOL1YL)2OXOETHYL)3A6ADIHYDROPYRROLO(34D)(123)TRIAZOLE46(1H5H)DIONE
5(3fluorophenyl)1(2(5(4methoxyphenyl)3(naphthalen1yl)45dihydro1Hpyrazol1yl)2oxoethyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
5(3FLUOROPHENYL)3(2(3(4METHOXYPHENYL)5NAPHTHALEN1YL34DIHYDROPYRAZOL2YL)2OXOETHYL)3A6ADIHYDROPYRROLO(34D)TRIAZOLE46DIONE
667406726
COC1=CC=C(C=C1)C2CC(=NN2C(=O)CN3C4C(C(=O)N(C4=O)C5=CC(=CC=C5)F)N=N3)C6=CC=CC7=CC=CC=C76
InChI=1SC32H25FN6O4c14323141220(131523)271726(251147196231024(19)25)3539(27)28(40)18373029(343637)31(41)38(32(30)42)2295821(33)1622h216272930H1718H21H3
MFCD03467630
ZINC000008455500
ZINC000245239977

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Available files

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