4-[cyclopropyl-[3-(7H-purin-6-ylsulfonylmethyl)phenyl]methyl]-5-oxidanyl-2,2-bis(phenylmethyl)furan-3-one

Systemtic Name: 4-[cyclopropyl-[3-(7H-purin-6-ylsulfonylmethyl)phenyl]methyl]-5-oxidanyl-2,2-bis(phenylmethyl)furan-3-one Openeye Name: 2,2-dibenzyl-4-[cyclopropyl-[3-(7H-purin-6-ylsulfonylmethyl)phenyl]methyl]-5-hydroxy-furan-3-one CAS Name: 4-[cyclopropyl-[3-(7H-purin-6-ylsulfonylmethyl)phenyl]methyl]-5-hydroxy-2,2-bis(phenylmethyl)-3-furanone IUPAC Name: 2,2-dibenzyl-4-[cyclopropyl-[3-(7H-purin-6-ylsulfonylmethyl)phenyl]methyl]-5-hydroxyfuran-3-one Traditional Name: 2,2-dibenzyl-4-[cyclopropyl-[3-(7H-purin-6-ylsulfonylmethyl)phenyl]methyl]-5-hydroxy-furan-3-one Formula: C34H30N4O5S MolecularWeight: 606.6908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CC(=C2)CS(=O)(=O)C3=NC=NC4=C3NC=N4)C5=C(OC(C5=O)(CC6=CC=CC=C6)CC7=CC=CC=C7)O

Isomeric SMILES

C1CC1C(C2=CC=CC(=C2)CS(=O)(=O)C3=NC=NC4=C3NC=N4)C5=C(OC(C5=O)(CC6=CC=CC=C6)CC7=CC=CC=C7)O

InChI

InChI=1S/C34H30N4O5S/c39-30-28(33(40)43-34(30,17-22-8-3-1-4-9-22)18-23-10-5-2-6-11-23)27(25-14-15-25)26-13-7-12-24(16-26)19-44(41,42)32-29-31(36-20-35-29)37-21-38-32/h1-13,16,20-21,25,27,40H,14-15,17-19H2,(H,35,36,37,38)