N-[(4-chlorophenyl)methyl]-8-methyl-2-methylsulfanyl-5H-purin-6-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-methyl-2-methylsulfanyl-5H-purin-6-amine Openeye Name: N-[(4-chlorophenyl)methyl]-8-methyl-2-methylsulfanyl-5H-purin-6-amine CAS Name: N-[(4-chlorophenyl)methyl]-8-methyl-2-(methylthio)-5H-purin-6-amine IUPAC Name: N-[(4-chlorophenyl)methyl]-8-methyl-2-methylsulfanyl-5H-purin-6-amine Traditional Name: (4-chlorobenzyl)-[8-methyl-2-(methylthio)-5H-purin-6-yl]amine Formula: C14H14ClN5S MolecularWeight: 319.81246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2C(=N1)N=C(N=C2NCC3=CC=C(C=C3)Cl)SC

Isomeric SMILES

CC1=NC2C(=N1)N=C(N=C2NCC3=CC=C(C=C3)Cl)SC

InChI

InChI=1S/C14H14ClN5S/c1-8-17-11-12(19-14(21-2)20-13(11)18-8)16-7-9-3-5-10(15)6-4-9/h3-6,11H,7H2,1-2H3,(H,16,17,18,19,20)