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

Systemtic Name: 8-(3-azanylpyrrolidin-1-yl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione Openeye Name: 8-(3-aminopyrrolidin-1-yl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione CAS Name: 8-(3-amino-1-pyrrolidinyl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione IUPAC Name: 8-(3-aminopyrrolidin-1-yl)-1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione Traditional Name: 8-(3-aminopyrrolidino)-1,3-dimethyl-7-(3-methylbut-2-enyl)xanthine Formula: C16H24N6O2 MolecularWeight: 332.40076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(N=C1N3CCC(C3)N)N(C(=O)N(C2=O)C)C)C

Isomeric SMILES

CC(=CCN1C2=C(N=C1N3CCC(C3)N)N(C(=O)N(C2=O)C)C)C

InChI

InChI=1S/C16H24N6O2/c1-10(2)5-8-22-12-13(19(3)16(24)20(4)14(12)23)18-15(22)21-7-6-11(17)9-21/h5,11H,6-9,17H2,1-4H3