Vitas-M small molecule compound
bis[4-(dimethylamino)phenyl](1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methylium
Catalog ID
STL059092
SMILES CN(c1ccc(cc1)[C+](c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)N(C)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 C28H31N4O MW 439.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N4O/c1-20-26(28(33)32(31(20)6)25-10-8-7-9-11-25)27(21-12-16-23(17-13-21)29(2)3)22-14-18-24(19-15-22)30(4)5/h7-19H,1-6H3/q+1InChIKey
BAFNTIJAINLLOZ-UHFFFAOYSA-NSynonyms
(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)bis(4(dimethylamino)phenyl)methyliumchloride
4(bis(4(dimethylamino)phenyl)methylidene)15dimethyl2phenylpyrazol1ium3one
4(BIS(4(DIMETHYLAMINO)PHENYL)METHYLIDENE)23DIMETHYL5OXO1PHENYL45DIHYDRO1HPYRAZOL2IUM
4(BIS(4DIMETHYLAMINOPHENYL)METHYLIDENE)15DIMETHYL2PHENYLPYRAZOL1IUM3ONE
bis(4(dimethylamino)phenyl)(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)methylium
CC1=(N+)(N(C(=O)C1=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=CC=C4)C
CN(c1ccc(cc1)(C+)(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)N(C)C)C
CN(c1ccc(cc1)(C+)(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)N(C)C)C(Cl)
InChI=1SC28H31N4Oc12026(28(33)32(31(20)6)25108791125)27(21121623(171321)29(2)3)22141824(191522)30(4)5h719H16H3q+1
ZINC000013764060
ZINC13764060
Check stock
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Check stock on Vitas-MAvailable files
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