1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-(4-oxidanylbutan-2-ylamino)-4,5-dihydropurine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-(4-oxidanylbutan-2-ylamino)-4,5-dihydropurine-2,6-dione Openeye Name: 8-[(3-hydroxy-1-methyl-propyl)amino]-1,3-dimethyl-7-(1-naphthylmethyl)-4,5-dihydropurine-2,6-dione CAS Name: 8-(4-hydroxybutan-2-ylamino)-1,3-dimethyl-7-(1-naphthalenylmethyl)-4,5-dihydropurine-2,6-dione IUPAC Name: 8-(4-hydroxybutan-2-ylamino)-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-4,5-dihydropurine-2,6-dione Traditional Name: 8-[(3-hydroxy-1-methyl-propyl)amino]-1,3-dimethyl-7-(1-naphthylmethyl)-4,5-dihydropurine-2,6-quinone Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)NC1=NC2C(N1CC3=CC=CC4=CC=CC=C43)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(CCO)NC1=NC2C(N1CC3=CC=CC4=CC=CC=C43)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C22H27N5O3/c1-14(11-12-28)23-21-24-19-18(20(29)26(3)22(30)25(19)2)27(21)13-16-9-6-8-15-7-4-5-10-17(15)16/h4-10,14,18-19,28H,11-13H2,1-3H3,(H,23,24)