8-(dicyclopropylmethyl)-2-(phenylmethylsulfanyl)-9-(triphenylmethyl)-7,8-dihydro-3H-purin-6-one

Systemtic Name: 8-(dicyclopropylmethyl)-2-(phenylmethylsulfanyl)-9-(triphenylmethyl)-7,8-dihydro-3H-purin-6-one Openeye Name: 2-benzylsulfanyl-8-(dicyclopropylmethyl)-9-trityl-7,8-dihydro-3H-purin-6-one CAS Name: 8-(dicyclopropylmethyl)-2-(phenylmethylthio)-9-(triphenylmethyl)-7,8-dihydro-3H-purin-6-one IUPAC Name: 2-benzylsulfanyl-8-(dicyclopropylmethyl)-9-trityl-7,8-dihydro-3H-purin-6-one Traditional Name: 2-(benzylthio)-8-(dicyclopropylmethyl)-9-trityl-7,8-dihydro-3H-purin-6-one Formula: C38H36N4OS MolecularWeight: 596.78364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2CC2)C3NC4=C(N3C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)NC(=NC4=O)SCC8=CC=CC=C8

Isomeric SMILES

C1CC1C(C2CC2)C3NC4=C(N3C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)NC(=NC4=O)SCC8=CC=CC=C8

InChI

InChI=1S/C38H36N4OS/c43-36-33-35(40-37(41-36)44-25-26-13-5-1-6-14-26)42(34(39-33)32(27-21-22-27)28-23-24-28)38(29-15-7-2-8-16-29,30-17-9-3-10-18-30)31-19-11-4-12-20-31/h1-20,27-28,32,34,39H,21-25H2,(H,40,41,43)