N-[9-[(2S,3S)-3-phenylselanyloxan-2-yl]purin-6-yl]benzamide

Systemtic Name: N-[9-[(2S,3S)-3-phenylselanyloxan-2-yl]purin-6-yl]benzamide Openeye Name: N-[9-[(2S,3S)-3-phenylselanyltetrahydropyran-2-yl]purin-6-yl]benzamide CAS Name: N-[9-[(2S,3S)-3-(phenylseleno)-2-oxanyl]-6-purinyl]benzamide IUPAC Name: N-[9-[(2S,3S)-3-phenylselanyloxan-2-yl]purin-6-yl]benzamide Traditional Name: N-[9-[(2S,3S)-3-(phenylseleno)tetrahydropyran-2-yl]purin-6-yl]benzamide Formula: C23H21N5O2Se MolecularWeight: 478.40514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(OC1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)[Se]C5=CC=CC=C5

Isomeric SMILES

C1C[C@@H]([C@H](OC1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)[Se]C5=CC=CC=C5

InChI

InChI=1S/C23H21N5O2Se/c29-22(16-8-3-1-4-9-16)27-20-19-21(25-14-24-20)28(15-26-19)23-18(12-7-13-30-23)31-17-10-5-2-6-11-17/h1-6,8-11,14-15,18,23H,7,12-13H2,(H,24,25,27,29)/t18-,23-/m0/s1