7-butyl-3-methyl-8-[methyl-(phenylmethyl)amino]-4,5-dihydropurine-2,6-dione

Systemtic Name: 7-butyl-3-methyl-8-[methyl-(phenylmethyl)amino]-4,5-dihydropurine-2,6-dione Openeye Name: 8-[benzyl(methyl)amino]-7-butyl-3-methyl-4,5-dihydropurine-2,6-dione CAS Name: 7-butyl-3-methyl-8-[methyl-(phenylmethyl)amino]-4,5-dihydropurine-2,6-dione IUPAC Name: 8-[benzyl(methyl)amino]-7-butyl-3-methyl-4,5-dihydropurine-2,6-dione Traditional Name: 8-[benzyl(methyl)amino]-7-butyl-3-methyl-4,5-dihydropurine-2,6-quinone Formula: C18H25N5O2 MolecularWeight: 343.4234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2C(N=C1N(C)CC3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCN1C2C(N=C1N(C)CC3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C18H25N5O2/c1-4-5-11-23-14-15(22(3)18(25)20-16(14)24)19-17(23)21(2)12-13-9-7-6-8-10-13/h6-10,14-15H,4-5,11-12H2,1-3H3,(H,20,24,25)