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N-[(4-chlorophenyl)methyl]-8-methylsulfanyl-7H-purin-6-amine

N-[(4-chlorophenyl)methyl]-8-methylsulfanyl-7H-purin-6-amine

Systemtic Name:N-[(4-chlorophenyl)methyl]-8-methylsulfanyl-7H-purin-6-amine
Openeye Name:N-[(4-chlorophenyl)methyl]-8-methylsulfanyl-7H-purin-6-amine
CAS Name:N-[(4-chlorophenyl)methyl]-8-(methylthio)-7H-purin-6-amine
IUPAC Name:N-[(4-chlorophenyl)methyl]-8-methylsulfanyl-7H-purin-6-amine
Traditional Name:(4-chlorobenzyl)-[8-(methylthio)-7H-purin-6-yl]amine
Formula: C13H12ClN5S
MolecularWeight: 305.78588
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1)C(=NC=N2)NCC3=CC=C(C=C3)Cl


Isomeric SMILES

CSC1=NC2=C(N1)C(=NC=N2)NCC3=CC=C(C=C3)Cl


InChI

InChI=1S/C13H12ClN5S/c1-20-13-18-10-11(16-7-17-12(10)19-13)15-6-8-2-4-9(14)5-3-8/h2-5,7H,6H2,1H3,(H2,15,16,17,18,19)


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