N-[9-[1,4-bis[(4-methoxyphenyl)methoxy]butan-2-yloxy]-6-chloranyl-purin-2-yl]methanamide

Systemtic Name: N-[9-[1,4-bis[(4-methoxyphenyl)methoxy]butan-2-yloxy]-6-chloranyl-purin-2-yl]methanamide Openeye Name: N-[6-chloro-9-[3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methoxymethyl]propoxy]purin-2-yl]formamide CAS Name: N-[9-[1,4-bis[(4-methoxyphenyl)methoxy]butan-2-yloxy]-6-chloro-2-purinyl]formamide IUPAC Name: N-[9-[1,4-bis[(4-methoxyphenyl)methoxy]butan-2-yloxy]-6-chloropurin-2-yl]formamide Traditional Name: N-[6-chloro-9-[3-p-anisyloxy-1-(p-anisyloxymethyl)propoxy]purin-2-yl]formamide Formula: C26H28ClN5O6 MolecularWeight: 541.98342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COCCC(COCC2=CC=C(C=C2)OC)ON3C=NC4=C3N=C(N=C4Cl)NC=O

Isomeric SMILES

COC1=CC=C(C=C1)COCCC(COCC2=CC=C(C=C2)OC)ON3C=NC4=C3N=C(N=C4Cl)NC=O

InChI

InChI=1S/C26H28ClN5O6/c1-34-20-7-3-18(4-8-20)13-36-12-11-22(15-37-14-19-5-9-21(35-2)10-6-19)38-32-16-28-23-24(27)30-26(29-17-33)31-25(23)32/h3-10,16-17,22H,11-15H2,1-2H3,(H,29,30,31,33)