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

Systemtic Name: 1,3-dimethyl-7-[3-[(3S)-3-methylpiperidin-1-yl]-3-oxidanylidene-propyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[3-[(3S)-3-methyl-1-piperidyl]-3-oxo-propyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[3-[(3S)-3-methyl-1-piperidinyl]-3-oxopropyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[3-[(3S)-3-methylpiperidin-1-yl]-3-oxopropyl]purine-2,6-dione Traditional Name: 7-[3-keto-3-[(3S)-3-methylpiperidino]propyl]-1,3-dimethyl-xanthine Formula: C16H23N5O3 MolecularWeight: 333.38552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

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