8-(phenylmethyl)-4-propyl-2-thiophen-2-yl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one

Systemtic Name: 8-(phenylmethyl)-4-propyl-2-thiophen-2-yl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one Openeye Name: 8-benzyl-4-propyl-2-(2-thienyl)-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one CAS Name: 8-(phenylmethyl)-4-propyl-2-thiophen-2-yl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one IUPAC Name: 8-benzyl-4-propyl-2-thiophen-2-yl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one Traditional Name: 8-benzyl-4-propyl-2-(2-thienyl)-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C3=NC(CN3C1=O)CC4=CC=CC=C4)NC(=N2)C5=CC=CS5

Isomeric SMILES

CCCN1C2=C(C3=NC(CN3C1=O)CC4=CC=CC=C4)NC(=N2)C5=CC=CS5

InChI

InChI=1S/C21H21N5OS/c1-2-10-25-20-17(23-18(24-20)16-9-6-11-28-16)19-22-15(13-26(19)21(25)27)12-14-7-4-3-5-8-14/h3-9,11,15H,2,10,12-13H2,1H3,(H,23,24)