Vitas-M small molecule compound

3-(4-chlorophenyl)-1-(2-hydroxyethyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione

Catalog ID
STK761780
SMILES OCCN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)Cl

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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 C17H17ClN6O3 MW 388.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN6O3/c1-21-14-13(15(26)22(2)17(21)27)23-9-12(10-3-5-11(18)6-4-10)20-24(7-8-25)16(23)19-14/h3-6,25H,7-9H2,1-2H3
InChIKey
PCDJUZWFLURFFL-UHFFFAOYSA-N
Synonyms
309289-96-1
3(4chlorophenyl)1(2hydroxyethyl)79dimethyl14dihydro(124)triazino(34f)purine68(7H9H)dione
3(4CHLOROPHENYL)1(2HYDROXYETHYL)79DIMETHYL4HPURINO(87C)(124)TRIAZINE68DIONE
3(4chlorophenyl)1(2hydroxyethyl)79dimethyl79dihydro(124)triazino(34f)purine68(1H4H)dione
309289961
8H124A689HEXAAZAFLUORENE57DIONE3(4CHLOROPHENYL)1(2HYDROXYETHYL)68DIMETHYL14DIHYDRO
CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CCO)C4=CC=C(C=C4)Cl
InChI=1SC17H17ClN6O3c1211413(15(26)22(2)17(21)27)23912(103511(18)6410)2024(7825)16(23)1914h3625H79H212H3
MFCD01871064
ZINC000004123622
ZINC04123622
ZINC4123622

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Available files

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