(4S,5R)-1-methyl-8-phenyl-9-propyl-4,5-dihydro-3H-purine-2,6-dione

Systemtic Name: (4S,5R)-1-methyl-8-phenyl-9-propyl-4,5-dihydro-3H-purine-2,6-dione Openeye Name: (4S,5R)-1-methyl-8-phenyl-9-propyl-4,5-dihydro-3H-purine-2,6-dione CAS Name: (4S,5R)-1-methyl-8-phenyl-9-propyl-4,5-dihydro-3H-purine-2,6-dione IUPAC Name: (4S,5R)-1-methyl-8-phenyl-9-propyl-4,5-dihydro-3H-purine-2,6-dione Traditional Name: (4S,5R)-1-methyl-8-phenyl-9-propyl-4,5-dihydro-3H-purine-2,6-quinone Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2C(C(=O)N(C(=O)N2)C)N=C1C3=CC=CC=C3

Isomeric SMILES

CCCN1[C@H]2[C@H](C(=O)N(C(=O)N2)C)N=C1C3=CC=CC=C3

InChI

InChI=1S/C15H18N4O2/c1-3-9-19-12(10-7-5-4-6-8-10)16-11-13(19)17-15(21)18(2)14(11)20/h4-8,11,13H,3,9H2,1-2H3,(H,17,21)/t11-,13+/m1/s1