8-(3-azanylpiperidin-1-yl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione

Systemtic Name: 8-(3-azanylpiperidin-1-yl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione Openeye Name: 8-(3-amino-1-piperidyl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione CAS Name: 8-(3-amino-1-piperidinyl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione IUPAC Name: 8-(3-aminopiperidin-1-yl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione Traditional Name: 8-(3-aminopiperidino)-1,3-dimethyl-7-(3-methylbut-2-enyl)xanthine Formula: C17H26N6O2 MolecularWeight: 346.42734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(N=C1N3CCCC(C3)N)N(C(=O)N(C2=O)C)C)C

Isomeric SMILES

CC(=CCN1C2=C(N=C1N3CCCC(C3)N)N(C(=O)N(C2=O)C)C)C

InChI

InChI=1S/C17H26N6O2/c1-11(2)7-9-23-13-14(20(3)17(25)21(4)15(13)24)19-16(23)22-8-5-6-12(18)10-22/h7,12H,5-6,8-10,18H2,1-4H3