2-acetamido-N,N-diphenyl-9-(2-phenylselanylethoxymethyl)purine-6-carboxamide

Systemtic Name: 2-acetamido-N,N-diphenyl-9-(2-phenylselanylethoxymethyl)purine-6-carboxamide Openeye Name: 2-acetamido-N,N-diphenyl-9-(2-phenylselanylethoxymethyl)purine-6-carboxamide CAS Name: 2-acetamido-N,N-diphenyl-9-[2-(phenylseleno)ethoxymethyl]-6-purinecarboxamide IUPAC Name: 2-acetamido-N,N-diphenyl-9-(2-phenylselanylethoxymethyl)purine-6-carboxamide Traditional Name: 2-acetamido-N,N-diphenyl-9-[2-(phenylseleno)ethoxymethyl]purine-6-carboxamide Formula: C29H26N6O3Se MolecularWeight: 585.51514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=C2C(=N1)N(C=N2)COCC[Se]C3=CC=CC=C3)C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1=NC(=C2C(=N1)N(C=N2)COCC[Se]C3=CC=CC=C3)C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N6O3Se/c1-21(36)31-29-32-26(28(37)35(22-11-5-2-6-12-22)23-13-7-3-8-14-23)25-27(33-29)34(19-30-25)20-38-17-18-39-24-15-9-4-10-16-24/h2-16,19H,17-18,20H2,1H3,(H,31,32,33,36)