N-[(2R,3R,4S,5R)-5-(hydroxymethyl)-2-[6-[[(1R)-1-naphthalen-1-ylethyl]amino]purin-9-yl]-4-oxidanyl-oxolan-3-yl]-4-methoxy-quinoline-2-carboxamide

Systemtic Name: N-[(2R,3R,4S,5R)-5-(hydroxymethyl)-2-[6-[[(1R)-1-naphthalen-1-ylethyl]amino]purin-9-yl]-4-oxidanyl-oxolan-3-yl]-4-methoxy-quinoline-2-carboxamide Openeye Name: N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-[6-[[(1R)-1-(1-naphthyl)ethyl]amino]purin-9-yl]tetrahydrofuran-3-yl]-4-methoxy-quinoline-2-carboxamide CAS Name: N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-[6-[[(1R)-1-(1-naphthalenyl)ethyl]amino]-9-purinyl]-3-oxolanyl]-4-methoxy-2-quinolinecarboxamide IUPAC Name: N-[(2R,3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-[6-[[(1R)-1-naphthalen-1-ylethyl]amino]purin-9-yl]oxolan-3-yl]-4-methoxyquinoline-2-carboxamide Traditional Name: N-[(2R,3R,4S,5R)-4-hydroxy-5-methylol-2-[6-[[(1R)-1-(1-naphthyl)ethyl]amino]purin-9-yl]tetrahydrofuran-3-yl]-4-methoxy-quinaldamide Formula: C33H31N7O5 MolecularWeight: 605.64314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC3=NC=NC4=C3N=CN4C5C(C(C(O5)CO)O)NC(=O)C6=NC7=CC=CC=C7C(=C6)OC

Isomeric SMILES

C[C@H](C1=CC=CC2=CC=CC=C21)NC3=NC=NC4=C3N=CN4[C@H]5[C@@H]([C@@H]([C@H](O5)CO)O)NC(=O)C6=NC7=CC=CC=C7C(=C6)OC

InChI

InChI=1S/C33H31N7O5/c1-18(20-12-7-9-19-8-3-4-10-21(19)20)37-30-28-31(35-16-34-30)40(17-36-28)33-27(29(42)26(15-41)45-33)39-32(43)24-14-25(44-2)22-11-5-6-13-23(22)38-24/h3-14,16-18,26-27,29,33,41-42H,15H2,1-2H3,(H,39,43)(H,34,35,37)/t18-,26-,27-,29-,33-/m1/s1