6-cyclopentyl-6-[2-(4-methoxyphenyl)ethyl]-3-[(6-oxidanylidene-3,7-dihydropurin-2-yl)sulfanyl]oxane-2,4-dione

Systemtic Name: 6-cyclopentyl-6-[2-(4-methoxyphenyl)ethyl]-3-[(6-oxidanylidene-3,7-dihydropurin-2-yl)sulfanyl]oxane-2,4-dione Openeye Name: 6-cyclopentyl-6-[2-(4-methoxyphenyl)ethyl]-3-[(6-oxo-3,7-dihydropurin-2-yl)sulfanyl]tetrahydropyran-2,4-dione CAS Name: 6-cyclopentyl-6-[2-(4-methoxyphenyl)ethyl]-3-[(6-oxo-3,7-dihydropurin-2-yl)thio]oxane-2,4-dione IUPAC Name: 6-cyclopentyl-6-[2-(4-methoxyphenyl)ethyl]-3-[(6-oxo-3,7-dihydropurin-2-yl)sulfanyl]oxane-2,4-dione Traditional Name: 6-cyclopentyl-3-[(6-keto-3,7-dihydropurin-2-yl)thio]-6-[2-(4-methoxyphenyl)ethyl]tetrahydropyran-2,4-quinone Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2(CC(=O)C(C(=O)O2)SC3=NC(=O)C4=C(N3)N=CN4)C5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)CCC2(CC(=O)C(C(=O)O2)SC3=NC(=O)C4=C(N3)N=CN4)C5CCCC5

InChI

InChI=1S/C24H26N4O5S/c1-32-16-8-6-14(7-9-16)10-11-24(15-4-2-3-5-15)12-17(29)19(22(31)33-24)34-23-27-20-18(21(30)28-23)25-13-26-20/h6-9,13,15,19H,2-5,10-12H2,1H3,(H2,25,26,27,28,30)