7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione

Systemtic Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione Openeye Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione CAS Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione IUPAC Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione Traditional Name: 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=O)N2)CCCN3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=O)N2)CCCN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H23N5O3/c1-21-16-15(17(25)22(2)19(21)27)24(18(26)20-16)10-5-9-23-11-8-13-6-3-4-7-14(13)12-23/h3-4,6-7H,5,8-12H2,1-2H3,(H,20,26)