7-butan-2-yl-3-(2-ethoxyethyl)-1-methyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 7-butan-2-yl-3-(2-ethoxyethyl)-1-methyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 3-(2-ethoxyethyl)-1-methyl-8-piperazin-1-yl-7-sec-butyl-purine-2,6-dione CAS Name: 7-butan-2-yl-3-(2-ethoxyethyl)-1-methyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-butan-2-yl-3-(2-ethoxyethyl)-1-methyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 3-(2-ethoxyethyl)-1-methyl-8-piperazino-7-sec-butyl-xanthine Formula: C18H30N6O3 MolecularWeight: 378.4692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C)CCOCC

Isomeric SMILES

CCC(C)N1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C)CCOCC

InChI

InChI=1S/C18H30N6O3/c1-5-13(3)24-14-15(20-17(24)22-9-7-19-8-10-22)23(11-12-27-6-2)18(26)21(4)16(14)25/h13,19H,5-12H2,1-4H3