N-[2-(6-azanyl-8-thiophen-2-yl-purin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]benzamide

Systemtic Name: N-[2-(6-azanyl-8-thiophen-2-yl-purin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]benzamide Openeye Name: N-[2-[6-amino-8-(2-thienyl)purin-9-yl]-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]benzamide CAS Name: N-[2-(6-amino-8-thiophen-2-yl-9-purinyl)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]benzamide IUPAC Name: N-[2-(6-amino-8-thiophen-2-ylpurin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]benzamide Traditional Name: N-[2-[6-amino-8-(2-thienyl)purin-9-yl]-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]benzamide Formula: C21H20N6O4S MolecularWeight: 452.4863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2C(C(OC2N3C4=C(C(=NC=N4)N)N=C3C5=CC=CS5)CO)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2C(C(OC2N3C4=C(C(=NC=N4)N)N=C3C5=CC=CS5)CO)O

InChI

InChI=1S/C21H20N6O4S/c22-17-15-19(24-10-23-17)27(18(25-15)13-7-4-8-32-13)21-14(16(29)12(9-28)31-21)26-20(30)11-5-2-1-3-6-11/h1-8,10,12,14,16,21,28-29H,9H2,(H,26,30)(H2,22,23,24)