N-[9-[5-(hydroxymethyl)-4-[(triphenylmethyl)amino]oxolan-2-yl]purin-6-yl]benzamide

Systemtic Name: N-[9-[5-(hydroxymethyl)-4-[(triphenylmethyl)amino]oxolan-2-yl]purin-6-yl]benzamide Openeye Name: N-[9-[5-(hydroxymethyl)-4-(tritylamino)tetrahydrofuran-2-yl]purin-6-yl]benzamide CAS Name: N-[9-[5-(hydroxymethyl)-4-[(triphenylmethyl)amino]-2-oxolanyl]-6-purinyl]benzamide IUPAC Name: N-[9-[5-(hydroxymethyl)-4-(tritylamino)oxolan-2-yl]purin-6-yl]benzamide Traditional Name: N-[9-[5-methylol-4-(tritylamino)tetrahydrofuran-2-yl]purin-6-yl]benzamide Formula: C36H32N6O3 MolecularWeight: 596.67768

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)CO)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)CO)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C36H32N6O3/c43-22-30-29(41-36(26-15-7-2-8-16-26,27-17-9-3-10-18-27)28-19-11-4-12-20-28)21-31(45-30)42-24-39-32-33(37-23-38-34(32)42)40-35(44)25-13-5-1-6-14-25/h1-20,23-24,29-31,41,43H,21-22H2,(H,37,38,40,44)