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2-(2-ethylphenyl)-8-methyl-3-(7H-purin-6-ylsulfanylmethyl)quinoline

2-(2-ethylphenyl)-8-methyl-3-(7H-purin-6-ylsulfanylmethyl)quinoline

Systemtic Name:2-(2-ethylphenyl)-8-methyl-3-(7H-purin-6-ylsulfanylmethyl)quinoline
Openeye Name:2-(2-ethylphenyl)-8-methyl-3-(7H-purin-6-ylsulfanylmethyl)quinoline
CAS Name:2-(2-ethylphenyl)-8-methyl-3-[(7H-purin-6-ylthio)methyl]quinoline
IUPAC Name:2-(2-ethylphenyl)-8-methyl-3-(7H-purin-6-ylsulfanylmethyl)quinoline
Traditional Name:2-(2-ethylphenyl)-8-methyl-3-[(7H-purin-6-ylthio)methyl]quinoline
Formula: C24H21N5S
MolecularWeight: 411.52204
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C2=C(C=C3C=CC=C(C3=N2)C)CSC4=NC=NC5=C4NC=N5


Isomeric SMILES

CCC1=CC=CC=C1C2=C(C=C3C=CC=C(C3=N2)C)CSC4=NC=NC5=C4NC=N5


InChI

InChI=1S/C24H21N5S/c1-3-16-8-4-5-10-19(16)21-18(11-17-9-6-7-15(2)20(17)29-21)12-30-24-22-23(26-13-25-22)27-14-28-24/h4-11,13-14H,3,12H2,1-2H3,(H,25,26,27,28)


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