2-[6-(cyclopentylamino)-2-[(phenylmethyl)-pyrrolidin-3-yl-amino]purin-9-yl]-5-(2-ethyl-1,2,3,4-tetrazol-5-yl)oxolane-3,4-diol

Systemtic Name: 2-[6-(cyclopentylamino)-2-[(phenylmethyl)-pyrrolidin-3-yl-amino]purin-9-yl]-5-(2-ethyl-1,2,3,4-tetrazol-5-yl)oxolane-3,4-diol Openeye Name: 2-[2-[benzyl(pyrrolidin-3-yl)amino]-6-(cyclopentylamino)purin-9-yl]-5-(2-ethyltetrazol-5-yl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(cyclopentylamino)-2-[(phenylmethyl)-(3-pyrrolidinyl)amino]-9-purinyl]-5-(2-ethyl-5-tetrazolyl)oxolane-3,4-diol IUPAC Name: 2-[2-[benzyl(pyrrolidin-3-yl)amino]-6-(cyclopentylamino)purin-9-yl]-5-(2-ethyltetrazol-5-yl)oxolane-3,4-diol Traditional Name: 2-[2-[benzyl(pyrrolidin-3-yl)amino]-6-(cyclopentylamino)purin-9-yl]-5-(2-ethyltetrazol-5-yl)tetrahydrofuran-3,4-diol Formula: C28H37N11O3 MolecularWeight: 575.66528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1N=C(N=N1)C2C(C(C(O2)N3C=NC4=C3N=C(N=C4NC5CCCC5)N(CC6=CC=CC=C6)C7CCNC7)O)O

Isomeric SMILES

CCN1N=C(N=N1)C2C(C(C(O2)N3C=NC4=C3N=C(N=C4NC5CCCC5)N(CC6=CC=CC=C6)C7CCNC7)O)O

InChI

InChI=1S/C28H37N11O3/c1-2-39-35-25(34-36-39)23-21(40)22(41)27(42-23)38-16-30-20-24(31-18-10-6-7-11-18)32-28(33-26(20)38)37(19-12-13-29-14-19)15-17-8-4-3-5-9-17/h3-5,8-9,16,18-19,21-23,27,29,40-41H,2,6-7,10-15H2,1H3,(H,31,32,33)