4-[5-[8-cyclohexyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]pentanoyl]benzenesulfonyl fluoride

Systemtic Name: 4-[5-[8-cyclohexyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]pentanoyl]benzenesulfonyl fluoride Openeye Name: 4-[5-(8-cyclohexyl-2,6-dioxo-1-propyl-7H-purin-3-yl)pentanoyl]benzenesulfonyl fluoride CAS Name: 4-[5-(8-cyclohexyl-2,6-dioxo-1-propyl-7H-purin-3-yl)-1-oxopentyl]benzenesulfonyl fluoride IUPAC Name: 4-[5-(8-cyclohexyl-2,6-dioxo-1-propyl-7H-purin-3-yl)pentanoyl]benzenesulfonyl fluoride Traditional Name: 4-[5-(8-cyclohexyl-2,6-diketo-1-propyl-7H-purin-3-yl)pentanoyl]benzenesulfonyl fluoride Formula: C25H31FN4O5S MolecularWeight: 518.600843

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3CCCCC3)N(C1=O)CCCCC(=O)C4=CC=C(C=C4)S(=O)(=O)F

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3CCCCC3)N(C1=O)CCCCC(=O)C4=CC=C(C=C4)S(=O)(=O)F

InChI

InChI=1S/C25H31FN4O5S/c1-2-15-30-24(32)21-23(28-22(27-21)18-8-4-3-5-9-18)29(25(30)33)16-7-6-10-20(31)17-11-13-19(14-12-17)36(26,34)35/h11-14,18H,2-10,15-16H2,1H3,(H,27,28)