3-methyl-8-(methylamino)-7-(naphthalen-1-ylmethyl)purine-2,6-dione

Systemtic Name: 3-methyl-8-(methylamino)-7-(naphthalen-1-ylmethyl)purine-2,6-dione Openeye Name: 3-methyl-8-(methylamino)-7-(1-naphthylmethyl)purine-2,6-dione CAS Name: 3-methyl-8-(methylamino)-7-(1-naphthalenylmethyl)purine-2,6-dione IUPAC Name: 3-methyl-8-(methylamino)-7-(naphthalen-1-ylmethyl)purine-2,6-dione Traditional Name: 3-methyl-8-(methylamino)-7-(1-naphthylmethyl)xanthine Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)NC(=O)N2C

Isomeric SMILES

CNC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)NC(=O)N2C

InChI

InChI=1S/C18H17N5O2/c1-19-17-20-15-14(16(24)21-18(25)22(15)2)23(17)10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9H,10H2,1-2H3,(H,19,20)(H,21,24,25)