2-[(3,4-dichlorophenyl)methylamino]-7-[2-(2-hydroxyethyloxy)ethyl]-3H-purin-6-one

Systemtic Name: 2-[(3,4-dichlorophenyl)methylamino]-7-[2-(2-hydroxyethyloxy)ethyl]-3H-purin-6-one Openeye Name: 2-[(3,4-dichlorophenyl)methylamino]-7-[2-(2-hydroxyethoxy)ethyl]-3H-purin-6-one CAS Name: 2-[(3,4-dichlorophenyl)methylamino]-7-[2-(2-hydroxyethoxy)ethyl]-3H-purin-6-one IUPAC Name: 2-[(3,4-dichlorophenyl)methylamino]-7-[2-(2-hydroxyethoxy)ethyl]-3H-purin-6-one Traditional Name: 2-[(3,4-dichlorobenzyl)amino]-7-[2-(2-hydroxyethoxy)ethyl]-3H-purin-6-one Formula: C16H17Cl2N5O3 MolecularWeight: 398.24388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=NC(=O)C3=C(N2)N=CN3CCOCCO)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CNC2=NC(=O)C3=C(N2)N=CN3CCOCCO)Cl)Cl

InChI

InChI=1S/C16H17Cl2N5O3/c17-11-2-1-10(7-12(11)18)8-19-16-21-14-13(15(25)22-16)23(9-20-14)3-5-26-6-4-24/h1-2,7,9,24H,3-6,8H2,(H2,19,21,22,25)