2-[(4-butylphenyl)amino]-3,7-dihydropurine-6-thione

Systemtic Name: 2-[(4-butylphenyl)amino]-3,7-dihydropurine-6-thione Openeye Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione CAS Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione IUPAC Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione Traditional Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione Formula: C15H17N5S MolecularWeight: 299.39398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=S)C3=C(N2)N=CN3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=S)C3=C(N2)N=CN3

InChI

InChI=1S/C15H17N5S/c1-2-3-4-10-5-7-11(8-6-10)18-15-19-13-12(14(21)20-15)16-9-17-13/h5-9H,2-4H2,1H3,(H3,16,17,18,19,20,21)