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8-(4-chlorophenyl)sulfanyl-3-phenethyl-purin-6-amine

8-(4-chlorophenyl)sulfanyl-3-phenethyl-purin-6-amine

Systemtic Name:8-(4-chlorophenyl)sulfanyl-3-phenethyl-purin-6-amine
Openeye Name:8-(4-chlorophenyl)sulfanyl-3-phenethyl-purin-6-amine
CAS Name:8-[(4-chlorophenyl)thio]-3-phenethyl-6-purinamine
IUPAC Name:8-(4-chlorophenyl)sulfanyl-3-phenethylpurin-6-amine
Traditional Name:[8-[(4-chlorophenyl)thio]-3-phenethyl-purin-6-yl]amine
Formula: C19H16ClN5S
MolecularWeight: 381.88184
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=NC(=C3C2=NC(=N3)SC4=CC=C(C=C4)Cl)N


Isomeric SMILES

C1=CC=C(C=C1)CCN2C=NC(=C3C2=NC(=N3)SC4=CC=C(C=C4)Cl)N


InChI

InChI=1S/C19H16ClN5S/c20-14-6-8-15(9-7-14)26-19-23-16-17(21)22-12-25(18(16)24-19)11-10-13-4-2-1-3-5-13/h1-9,12H,10-11,21H2


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