7-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-[(2S)-2-ethylpiperidino]-2-keto-ethyl]-1,3-dimethyl-xanthine Formula: C16H23N5O3 MolecularWeight: 333.38552

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C16H23N5O3/c1-4-11-7-5-6-8-21(11)12(22)9-20-10-17-14-13(20)15(23)19(3)16(24)18(14)2/h10-11H,4-9H2,1-3H3/t11-/m0/s1