9-(4-ethylphenyl)-2-[(4-ethylphenyl)amino]-6-methyl-7H-purine-8-thione

Systemtic Name: 9-(4-ethylphenyl)-2-[(4-ethylphenyl)amino]-6-methyl-7H-purine-8-thione Openeye Name: 2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-7H-purine-8-thione CAS Name: 2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-7H-purine-8-thione IUPAC Name: 2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-7H-purine-8-thione Traditional Name: 2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-7H-purine-8-thione Formula: C22H23N5S MolecularWeight: 389.51652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=C3C(=N2)N(C(=S)N3)C4=CC=C(C=C4)CC)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=C3C(=N2)N(C(=S)N3)C4=CC=C(C=C4)CC)C

InChI

InChI=1S/C22H23N5S/c1-4-15-6-10-17(11-7-15)24-21-23-14(3)19-20(26-21)27(22(28)25-19)18-12-8-16(5-2)9-13-18/h6-13H,4-5H2,1-3H3,(H,25,28)(H,23,24,26)