Vitas-M small molecule compound

[N,N'-dimethyl-N-(methylcarbamoyl-kappaN)benzenecarboximidamidato-kappaN'](dipropyl)boron

Catalog ID
STL327013
SMILES CCC[B-]1(CCC)[N+](=C(c2ccccc2)N(C(=O)N1C)C)C

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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 C17H28BN3O MW 301.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H28BN3O/c1-6-13-18(14-7-2)20(4)16(15-11-9-8-10-12-15)19(3)17(22)21(18)5/h8-12H,6-7,13-14H2,1-5H3
InChIKey
XSRIHCJVKMQLOV-UHFFFAOYSA-N
Synonyms

(B)1(N(C(=O)N(C(=(N+)1C)C2=CC=CC=C2)C)C)(CCC)CCC
(NNdimethylN(methylcarbamoylkappaN)benzenecarboximidamidatokappaN)(dipropyl)boron
135trimethyl4oxo6phenyl22dipropyl2345tetrahydro1352triazaborinin1ium2uide
135TRIMETHYL6PHENYL22DIPROPYL35DIAZA1AZONIA2BORANUIDACYCLOHEX6EN4ONE
CCC(B)1(CCC)(N+)(=C(c2ccccc2)N(C(=O)N1C)C)C
InChI=1SC17H28BN3Oc161318(1472)20(4)16(151198101215)19(3)17(22)21(18)5h812H671314H215H3
MFCD01086509
ZINC000195795064
ZINC195795064

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Available files

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