Vitas-M small molecule compound
N~3~-(2-chloro-7H-purin-6-yl)-N-[4-(trifluoromethoxy)phenyl]-beta-alaninamide
Catalog ID
STK620721
SMILES O=C(Nc1ccc(cc1)OC(F)(F)F)CCNc1nc(Cl)nc2c1[nH]cn2
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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 C15H12ClF3N6O2 MW 400.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClF3N6O2/c16-14-24-12(11-13(25-14)22-7-21-11)20-6-5-10(26)23-8-1-3-9(4-2-8)27-15(17,18)19/h1-4,7H,5-6H2,(H,23,26)(H2,20,21,22,24,25)InChIKey
IRWUPCIQZCLDEL-UHFFFAOYSA-NSynonyms
929961-44-43((2chloro7Hpurin6yl)amino)N(4(trifluoromethoxy)phenyl)propanamide
3((2chloro9Hpurin6yl)amino)N(4(trifluoromethoxy)phenyl)propanamide
929961444
C1=CC(=CC=C1NC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl)OC(F)(F)F
InChI=1SC15H12ClF3N6O2c16142412(1113(2514)2272111)206510(26)238139(428)2715(1718)19h147H56H2(H2326)(H22021222425)
MFCD09793937
N~3~(2chloro7Hpurin6yl)N(4(trifluoromethoxy)phenyl)betaalaninamide
N3(2CHLORO7HPURIN6YL)N(4(TRIFLUOROMETHOXY)PHENYL)BETAALANINAMIDE
O=C(Nc1ccc(cc1)OC(F)(F)F)CCNc1nc(Cl)nc2c1(nH)cn2
O=C(Nc1ccc(cc1)OC(F)(F)F)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000009054062
ZINC09054062
ZINC9054062
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