6-(5-chloranylthiophen-2-yl)-3-(2-hydroxyethyloxymethyl)-5H-imidazo[1,2-a]purin-9-one

Systemtic Name: 6-(5-chloranylthiophen-2-yl)-3-(2-hydroxyethyloxymethyl)-5H-imidazo[1,2-a]purin-9-one Openeye Name: 6-(5-chloro-2-thienyl)-3-(2-hydroxyethoxymethyl)-5H-imidazo[1,2-a]purin-9-one CAS Name: 6-(5-chloro-2-thiophenyl)-3-(2-hydroxyethoxymethyl)-5H-imidazo[1,2-a]purin-9-one IUPAC Name: 6-(5-chlorothiophen-2-yl)-3-(2-hydroxyethoxymethyl)-5H-imidazo[1,2-a]purin-9-one Traditional Name: 6-(5-chloro-2-thienyl)-3-(2-hydroxyethoxymethyl)-5H-imidazo[1,2-a]purin-9-one Formula: C14H12ClN5O3S MolecularWeight: 365.79478

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)C2=CN3C(=O)C4=C(N=C3N2)N(C=N4)COCCO

Isomeric SMILES

C1=C(SC(=C1)Cl)C2=CN3C(=O)C4=C(N=C3N2)N(C=N4)COCCO

InChI

InChI=1S/C14H12ClN5O3S/c15-10-2-1-9(24-10)8-5-20-13(22)11-12(18-14(20)17-8)19(6-16-11)7-23-4-3-21/h1-2,5-6,21H,3-4,7H2,(H,17,18)