2-[(3-ethyl-4-methyl-phenyl)amino]-3,7-dihydropurin-6-one

Systemtic Name: 2-[(3-ethyl-4-methyl-phenyl)amino]-3,7-dihydropurin-6-one Openeye Name: 2-(3-ethyl-4-methyl-anilino)-3,7-dihydropurin-6-one CAS Name: 2-(3-ethyl-4-methylanilino)-3,7-dihydropurin-6-one IUPAC Name: 2-(3-ethyl-4-methylanilino)-3,7-dihydropurin-6-one Traditional Name: 2-(3-ethyl-4-methyl-anilino)-3,7-dihydropurin-6-one Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)NC2=NC(=O)C3=C(N2)N=CN3)C

Isomeric SMILES

CCC1=C(C=CC(=C1)NC2=NC(=O)C3=C(N2)N=CN3)C

InChI

InChI=1S/C14H15N5O/c1-3-9-6-10(5-4-8(9)2)17-14-18-12-11(13(20)19-14)15-7-16-12/h4-7H,3H2,1-2H3,(H3,15,16,17,18,19,20)