Vitas-M small molecule compound

diphenyl{1,1,1-trifluoro-4-[(thiophen-2-ylmethyl)imino-kappaN]pent-2-en-2-aminato-kappaN}boron

Catalog ID
STK151489
SMILES CC1=[N+](Cc2cccs2)[B-](NC(=C1)C(F)(F)F)(c1ccccc1)c1ccccc1

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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 C22H20BF3N2S MW 412.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BF3N2S/c1-17-15-21(22(24,25)26)27-23(18-9-4-2-5-10-18,19-11-6-3-7-12-19)28(17)16-20-13-8-14-29-20/h2-15,27H,16H2,1H3
InChIKey
AEZDEVXAJLEYBR-UHFFFAOYSA-N
Synonyms

(B)1(NC(=CC(=(N+)1CC2=CC=CS2)C)C(F)(F)F)(C3=CC=CC=C3)C4=CC=CC=C4
6METHYL22DIPHENYL1(THIOPHEN2YLMETHYL)4(TRIFLUOROMETHYL)3AZA1AZONIA2BORANUIDACYCLOHEXA46DIENE
CC1=(N+)(Cc2cccs2)(B)(NC(=C1)C(F)(F)F)(c1ccccc1)c1ccccc1
DIPHENYL(111TRIFLUORO4((THIOPHEN2YLMETHYL)IMINOKAPPAN)PENT2EN2AMINATOKAPPAN)BORON
InChI=1SC22H20BF3N2Sc1171521(22(2425)26)2723(189425101819116371219)28(17)1620138142920h21527H16H21H3
MFCD03447880
ZINC000334157470
ZINC169804011

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Available files

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