8-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-[4-[(5-methylisoxazol-3-yl)methoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[4-[(5-methyl-3-isoxazolyl)methoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-[4-[(5-methylisoxazol-3-yl)methoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-quinone Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)OCC4=NOC(=C4)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)OCC4=NOC(=C4)C

InChI

InChI=1S/C22H25N5O4/c1-4-10-26-20-18(21(28)27(11-5-2)22(26)29)23-19(24-20)15-6-8-17(9-7-15)30-13-16-12-14(3)31-25-16/h6-9,12H,4-5,10-11,13H2,1-3H3,(H,23,24)