9-[(1R,3S)-2-methylidene-3-[(triphenylmethyl)oxymethyl]cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one

Systemtic Name: 9-[(1R,3S)-2-methylidene-3-[(triphenylmethyl)oxymethyl]cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one Openeye Name: 2-(isobutylamino)-9-[(1R,3S)-2-methylene-3-(trityloxymethyl)cyclobutyl]-3H-purin-6-one CAS Name: 9-[(1R,3S)-2-methylene-3-[(triphenylmethyl)oxymethyl]cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one IUPAC Name: 9-[(1R,3S)-2-methylidene-3-(trityloxymethyl)cyclobutyl]-2-(2-methylpropylamino)-3H-purin-6-one Traditional Name: 2-(isobutylamino)-9-[(1R,3S)-2-methylene-3-(trityloxymethyl)cyclobutyl]-3H-purin-6-one Formula: C34H35N5O2 MolecularWeight: 545.674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C3=C)COC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)CNC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]3C[C@@H](C3=C)COC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H35N5O2/c1-23(2)20-35-33-37-31-30(32(40)38-33)36-22-39(31)29-19-25(24(29)3)21-41-34(26-13-7-4-8-14-26,27-15-9-5-10-16-27)28-17-11-6-12-18-28/h4-18,22-23,25,29H,3,19-21H2,1-2H3,(H2,35,37,38,40)/t25-,29-/m1/s1