Vitas-M small molecule compound
[2-(benzylimino-kappaN)-N-methylpyridine-1(2H)-carboxamidato-kappaN~1~](dipropyl)boron
Catalog ID
STL325995
SMILES CCC[B-]1(CCC)N(C)C(=O)n2c(=[N+]1Cc1ccccc1)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 C20H28BN3O MW 337.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28BN3O/c1-4-14-21(15-5-2)22(3)20(25)23-16-10-9-13-19(23)24(21)17-18-11-7-6-8-12-18/h6-13,16H,4-5,14-15,17H2,1-3H3InChIKey
LSUMGYAJRXXFGM-UHFFFAOYSA-NSynonyms
(2(benzyliminokappaN)Nmethylpyridine1(2H)carboxamidatokappaN~1~)(dipropyl)boron
(2(BENZYLIMINOKAPPAN)NMETHYLPYRIDINE1(2H)CARBOXAMIDATOKAPPAN1)(DIPROPYL)BORON
(B)1(N(C(=O)(N+)2=CC=CC=C2N1CC3=CC=CC=C3)C)(CCC)CCC
1benzyl3methyl4oxo22dipropyl34dihydro2Hpyrido(21d)(1352)triazaborinin1ium2uide
5BENZYL3METHYL44DIPROPYL35DIAZA1AZONIA4BORANUIDABICYCLO(440)DECA1(10)68TRIEN2ONE
CCC(B)1(CCC)N(C)C(=O)n2c(=(N+)1Cc1ccccc1)cccc2
InChI=1SC20H28BN3Oc141421(1552)22(3)20(25)23161091319(23)24(21)1718117681218h61316H45141517H213H3
MFCD01090031
ZINC000195824922
ZINC195824922
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