Vitas-M small molecule compound

(2E)-3-(3-nitrophenyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}prop-2-en-1-one

Catalog ID
STK323270
SMILES O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)/C=C/c1cccc(c1)[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 C20H18F3N3O3 MW 405.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3N3O3/c21-20(22,23)16-4-2-5-17(14-16)24-9-11-25(12-10-24)19(27)8-7-15-3-1-6-18(13-15)26(28)29/h1-8,13-14H,9-12H2/b8-7+
InChIKey
MQZJZZGCSXRWOV-BQYQJAHWSA-N
Synonyms
432498-56-1
(2E)3(3nitrophenyl)1(4(3(trifluoromethyl)phenyl)piperazin1yl)prop2en1one
(2E)3(3NITROPHENYL)1(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)PROP2EN1ONE
(E)3(3NITROPHENYL)1(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2EN1ONE
432498561
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC20H18F3N3O3c2120(2223)1642517(1416)2491125(121024)19(27)871531618(1315)26(28)29h181314H912H2b87+
MFCD03395386
O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000001149432
ZINC01149432
ZINC1149432

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Available files

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