Vitas-M small molecule compound

1-(4-fluorophenyl)-4-(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)piperazine

Catalog ID
STK588752
SMILES Fc1ccc(cc1)N1CCN(CC1)c1nc(nn1C)[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 C13H15FN6O2 MW 306.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15FN6O2/c1-17-13(15-12(16-17)20(21)22)19-8-6-18(7-9-19)11-4-2-10(14)3-5-11/h2-5H,6-9H2,1H3
InChIKey
CBEIWCMKEULQDG-UHFFFAOYSA-N
Synonyms
877777-61-2
1(4fluorophenyl)4(1methyl3nitro1H124triazol5yl)piperazine
1(4FLUOROPHENYL)4(2METHYL5NITRO124TRIAZOL3YL)PIPERAZINE
1(4FLUOROPHENYL)4(2METHYL5NITRO2H(124)TRIAZOL3YL)PIPERAZINE
877777612
CN1C(=NC(=N1)(N+)(=O)(O))N2CCN(CC2)C3=CC=C(C=C3)F
Fc1ccc(cc1)N1CCN(CC1)c1nc(nn1C)(N+)(=O)(O)
InChI=1SC13H15FN6O2c11713(1512(1617)20(21)22)198618(7919)114210(14)3511h25H69H21H3
MFCD05699804
ZINC000005516085
ZINC05516085
ZINC5516085

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Available files

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