N-[2-[2-(4-methylphenyl)sulfanylethylsulfanyl]ethyl]-7H-purin-6-amine

Systemtic Name: N-[2-[2-(4-methylphenyl)sulfanylethylsulfanyl]ethyl]-7H-purin-6-amine Openeye Name: N-[2-[2-(p-tolylsulfanyl)ethylsulfanyl]ethyl]-7H-purin-6-amine CAS Name: N-[2-[2-[(4-methylphenyl)thio]ethylthio]ethyl]-7H-purin-6-amine IUPAC Name: N-[2-[2-(4-methylphenyl)sulfanylethylsulfanyl]ethyl]-7H-purin-6-amine Traditional Name: 2-[2-(p-tolylthio)ethylthio]ethyl-(7H-purin-6-yl)amine Formula: C16H19N5S2 MolecularWeight: 345.48556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCSCCNC2=NC=NC3=C2NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)SCCSCCNC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C16H19N5S2/c1-12-2-4-13(5-3-12)23-9-8-22-7-6-17-15-14-16(19-10-18-14)21-11-20-15/h2-5,10-11H,6-9H2,1H3,(H2,17,18,19,20,21)