Vitas-M small molecule compound
2-[(2Z)-2-({2,5-dimethyl-1-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-1H-pyrrol-3-yl}methylidene)hydrazinyl]-5-nitropyridine
Catalog ID
STK198228
SMILES [O-][N+](=O)c1ccc(nc1)N/N=C\c1cc(n(c1C)c1ccc(cc1)C12CC3CC(C2)CC(C1)C3)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 C28H31N5O2 MW 469.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2/c1-18-9-23(16-30-31-27-8-7-26(17-29-27)33(34)35)19(2)32(18)25-5-3-24(4-6-25)28-13-20-10-21(14-28)12-22(11-20)15-28/h3-9,16-17,20-22H,10-15H2,1-2H3,(H,29,31)/b30-16-InChIKey
WOCRESGZIIHQQL-UHBFCERESA-NSynonyms
(O)(N+)(=O)c1ccc(nc1)NN=Cc1cc(n(c1C)c1ccc(cc1)C12CC3CC(C2)CC(C1)C3)C
2((2Z)2((25dimethyl1(4(tricyclo(3311~37~)dec1yl)phenyl)1Hpyrrol3yl)methylidene)hydrazinyl)5nitropyridine
CC1=CC(=C(N1C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C)C=NNC6=NC=C(C=C6)(N+)(=O)(O)
InChI=1SC28H31N5O2c118923(163031278726(172927)33(34)35)19(2)32(18)255324(4625)2813201021(1428)1222(1120)1528h3916172022H1015H212H3(H2931)b3016
MFCD04547067
N((Z)(1(4(1adamantyl)phenyl)25dimethylpyrrol3yl)methylideneamino)5nitropyridin2amine
ZINC000009311810
ZINC59925130
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Check stock on Vitas-MAvailable files
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