Vitas-M small molecule compound

2-[5-(4-ethylpiperazin-1-yl)-4-fluoro-2-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline

Catalog ID
STK684282
SMILES CCN1CCN(CC1)c1cc(N2CCc3c(C2)cccc3)c(cc1F)[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 C21H25FN4O2 MW 384.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25FN4O2/c1-2-23-9-11-24(12-10-23)19-14-20(21(26(27)28)13-18(19)22)25-8-7-16-5-3-4-6-17(16)15-25/h3-6,13-14H,2,7-12,15H2,1H3
InChIKey
PSWOCJAFXWUZJF-UHFFFAOYSA-N
Synonyms

2(5(4ethylpiperazin1yl)4fluoro2nitrophenyl)1234tetrahydroisoquinoline
2(5(4ETHYLPIPERAZIN1YL)4FLUORO2NITROPHENYL)34DIHYDRO1HISOQUINOLINE
CCN1CCN(CC1)c1cc(N2CCc3c(C2)cccc3)c(cc1F)(N+)(=O)(O)
CCN1CCN(CC1)C2=C(C=C(C(=C2)N3CCC4=CC=CC=C4C3)(N+)(=O)(O))F
InChI=1SC21H25FN4O2c122391124(121023)191420(21(26(27)28)1318(19)22)258716534617(16)1525h361314H271215H21H3
MFCD05260249
ZINC000004624610
ZINC4624610

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Available files

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