Vitas-M small molecule compound

3-(3-oxo-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propyl)-1,2,3-benzotriazin-4(3H)-one

Catalog ID
STK581113
SMILES O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)CCn1nnc2c(c1=O)cccc2

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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 C21H20F3N5O2 MW 431.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O2/c22-21(23,24)15-4-3-5-16(14-15)27-10-12-28(13-11-27)19(30)8-9-29-20(31)17-6-1-2-7-18(17)25-26-29/h1-7,14H,8-13H2
InChIKey
QAQZINXGTYXICU-UHFFFAOYSA-N
Synonyms
900297-09-8
3(3oxo3(4(3(trifluoromethyl)phenyl)piperazin1yl)propyl)123benzotriazin4(3H)one
3(3OXO3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROPYL)123BENZOTRIAZIN4ONE
3(3oxo3(4(3(trifluoromethyl)phenyl)piperazin1yl)propyl)benzo(d)(123)triazin4(3H)one
900297098
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3
InChI=1SC21H20F3N5O2c2221(2324)1543516(1415)27101228(131127)19(30)892920(31)17612718(17)252629h1714H813H2
MFCD06773561
ZINC000009579911
ZINC09579911
ZINC9579911

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Available files

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