Vitas-M small molecule compound
1-{2-[(4-fluorophenyl)amino]ethyl}-7,9-dimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STK637797
SMILES Fc1ccc(cc1)NCCN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1
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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 C23H22FN7O2 MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN7O2/c1-28-20-19(21(32)29(2)23(28)33)30-14-18(15-6-4-3-5-7-15)27-31(22(30)26-20)13-12-25-17-10-8-16(24)9-11-17/h3-11,25H,12-14H2,1-2H3InChIKey
PNNSYXLZQBRSTO-UHFFFAOYSA-NSynonyms
923168-08-51(2((4fluorophenyl)amino)ethyl)79dimethyl3phenyl14dihydro(124)triazino(34f)purine68(7H9H)dione
1(2((4fluorophenyl)amino)ethyl)79dimethyl3phenyl79dihydro(124)triazino(34f)purine68(1H4H)dione
1(2(4fluoroanilino)ethyl)79dimethyl3phenyl4Hpurino(87c)(124)triazine68dione
923168085
CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CCNC4=CC=C(C=C4)F)C5=CC=CC=C5
InChI=1SC23H22FN7O2c1282019(21(32)29(2)23(28)33)301418(156435715)2731(22(30)2620)1312251710816(24)91117h31125H1214H212H3
MFCD09003231
ZINC000010108982
ZINC10108982
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