[3-[[9-[5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]-phenyl-methanone

Systemtic Name: [3-[[9-[5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]-phenyl-methanone Openeye Name: [3-[[9-[3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]-phenyl-methanone CAS Name: [3-[[9-[3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]amino]-1-pyrrolidinyl]-phenylmethanone IUPAC Name: [3-[[9-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]-phenylmethanone Traditional Name: [3-[[9-(3-hydroxy-5-methylol-tetrahydrofuran-2-yl)purin-6-yl]amino]pyrrolidino]-phenyl-methanone Formula: C21H24N6O4 MolecularWeight: 424.45306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC2=NC=NC3=C2N=CN3C4C(CC(O4)CO)O)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC1NC2=NC=NC3=C2N=CN3C4C(CC(O4)CO)O)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C21H24N6O4/c28-10-15-8-16(29)21(31-15)27-12-24-17-18(22-11-23-19(17)27)25-14-6-7-26(9-14)20(30)13-4-2-1-3-5-13/h1-5,11-12,14-16,21,28-29H,6-10H2,(H,22,23,25)