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7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(3-methylphenyl)methylsulfanyl]purine-2,6-dione

7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(3-methylphenyl)methylsulfanyl]purine-2,6-dione

Systemtic Name:7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(3-methylphenyl)methylsulfanyl]purine-2,6-dione
Openeye Name:7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-(m-tolylmethylsulfanyl)purine-2,6-dione
CAS Name:7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(3-methylphenyl)methylthio]purine-2,6-dione
IUPAC Name:7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(3-methylphenyl)methylsulfanyl]purine-2,6-dione
Traditional Name:7-(2-chlorobenzyl)-1,3-dimethyl-8-[(3-methylbenzyl)thio]xanthine
Formula: C22H21ClN4O2S
MolecularWeight: 440.94574
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)N(C(=O)N3C)C


Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)N(C(=O)N3C)C


InChI

InChI=1S/C22H21ClN4O2S/c1-14-7-6-8-15(11-14)13-30-21-24-19-18(20(28)26(3)22(29)25(19)2)27(21)12-16-9-4-5-10-17(16)23/h4-11H,12-13H2,1-3H3


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