Vitas-M small molecule compound
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]quinoxalin-2-amine
Catalog ID
STL432956
SMILES Cc1nn(c(c1)C)c1nc2ccccc2nc1Nc1ccc(cc1)C12CC3CC(C2)CC(C1)C3
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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 C29H31N5 MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5/c1-18-11-19(2)34(33-18)28-27(31-25-5-3-4-6-26(25)32-28)30-24-9-7-23(8-10-24)29-15-20-12-21(16-29)14-22(13-20)17-29/h3-11,20-22H,12-17H2,1-2H3,(H,30,31)InChIKey
DEGCPKNXPRABSP-UHFFFAOYSA-NSynonyms
3(35dimethyl1Hpyrazol1yl)N(4(tricyclo(3311~37~)dec1yl)phenyl)quinoxalin2amine
CC1=CC(=NN1C2=NC3=CC=CC=C3N=C2NC4=CC=C(C=C4)C56CC7CC(C5)CC(C7)C6)C
InChI=1SC29H31N5c1181119(2)34(3318)2827(3125534626(25)3228)30249723(81024)2915201221(1629)1422(1320)1729h3112022H1217H212H3(H3031)
N(4(1adamantyl)phenyl)3(35dimethylpyrazol1yl)quinoxalin2amine
ZINC000020058982
ZINC20058982
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