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

Systemtic Name: 2-(ethylsulfanylmethyl)-8-(phenylmethyl)-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one Openeye Name: 8-benzyl-2-(ethylsulfanylmethyl)-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one CAS Name: 2-[(ethylthio)methyl]-8-(phenylmethyl)-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one IUPAC Name: 8-benzyl-2-(ethylsulfanylmethyl)-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one Traditional Name: 8-benzyl-2-[(ethylthio)methyl]-4-propyl-7,8-dihydro-1H-imidazo[2,1-f]purin-5-one Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N5OS/c1-3-10-24-19-17(22-16(23-19)13-27-4-2)18-21-15(12-25(18)20(24)26)11-14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3,(H,22,23)