2-tert-butyl-5-methylsulfanyl-8-(phenylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine

Systemtic Name: 2-tert-butyl-5-methylsulfanyl-8-(phenylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine Openeye Name: 8-benzyl-2-tert-butyl-5-methylsulfanyl-7,8-dihydro-1H-imidazo[2,1-f]purine CAS Name: 2-tert-butyl-5-(methylthio)-8-(phenylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine IUPAC Name: 8-benzyl-2-tert-butyl-5-methylsulfanyl-7,8-dihydro-1H-imidazo[2,1-f]purine Traditional Name: 8-benzyl-2-tert-butyl-5-(methylthio)-7,8-dihydro-1H-imidazo[2,1-f]purine Formula: C19H23N5S MolecularWeight: 353.48442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1)C3=NC(CN3C(=N2)SC)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1)C3=NC(CN3C(=N2)SC)CC4=CC=CC=C4

InChI

InChI=1S/C19H23N5S/c1-19(2,3)17-21-14-15(22-17)23-18(25-4)24-11-13(20-16(14)24)10-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3,(H,21,22)