8-[(dipropylamino)methyl]-3-methyl-7-(3-oxidanylidenebutan-2-yl)purine-2,6-dione

Systemtic Name: 8-[(dipropylamino)methyl]-3-methyl-7-(3-oxidanylidenebutan-2-yl)purine-2,6-dione Openeye Name: 8-[(dipropylamino)methyl]-3-methyl-7-(1-methyl-2-oxo-propyl)purine-2,6-dione CAS Name: 8-[(dipropylamino)methyl]-3-methyl-7-(3-oxobutan-2-yl)purine-2,6-dione IUPAC Name: 8-[(dipropylamino)methyl]-3-methyl-7-(3-oxobutan-2-yl)purine-2,6-dione Traditional Name: 8-[(dipropylamino)methyl]-7-(2-keto-1-methyl-propyl)-3-methyl-xanthine Formula: C17H27N5O3 MolecularWeight: 349.42798

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC1=NC2=C(N1C(C)C(=O)C)C(=O)NC(=O)N2C

Isomeric SMILES

CCCN(CCC)CC1=NC2=C(N1C(C)C(=O)C)C(=O)NC(=O)N2C

InChI

InChI=1S/C17H27N5O3/c1-6-8-21(9-7-2)10-13-18-15-14(22(13)11(3)12(4)23)16(24)19-17(25)20(15)5/h11H,6-10H2,1-5H3,(H,19,24,25)