Vitas-M small molecule compound

4-(2-{[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]amino}ethyl)benzenesulfonamide

Catalog ID
STK272373
SMILES Clc1ccccc1Cn1c(NCCc2ccc(cc2)S(=O)(=O)N)nc2c1c(=O)n(c(=O)n2C)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 C22H23ClN6O4S MW 502.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN6O4S/c1-27-19-18(20(30)28(2)22(27)31)29(13-15-5-3-4-6-17(15)23)21(26-19)25-12-11-14-7-9-16(10-8-14)34(24,32)33/h3-10H,11-13H2,1-2H3,(H,25,26)(H2,24,32,33)
InChIKey
QMWBXQHMWYIGMH-UHFFFAOYSA-N
Synonyms

4(2((7((2CHLOROPHENYL)METHYL)13DIMETHYL26DIOXO137TRIHYDROPURIN8YL)AMINO)ETHYL)BENZENESULFONAMIDE
4(2((7((2CHLOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)AMINO)ETHYL)BENZENESULFONAMIDE
4(2((7(2chlorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)amino)ethyl)benzenesulfonamide
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCC3=CC=C(C=C3)S(=O)(=O)N)CC4=CC=CC=C4Cl
InChI=1SC22H23ClN6O4Sc1271918(20(30)28(2)22(27)31)29(1315534617(15)23)21(2619)251211147916(10814)34(2432)33h310H1113H212H3(H2526)(H2243233)
MFCD07621008
ZINC000008774906
ZINC08774906
ZINC8774906

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Available files

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