2-[1-[(2-fluoranyl-7H-purin-6-yl)amino]propyl]-3-phenyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[1-[(2-fluoranyl-7H-purin-6-yl)amino]propyl]-3-phenyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[1-[(2-fluoro-7H-purin-6-yl)amino]propyl]-3-phenyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[1-[(2-fluoro-7H-purin-6-yl)amino]propyl]-3-phenyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[1-[(2-fluoro-7H-purin-6-yl)amino]propyl]-3-phenylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[1-[(2-fluoro-7H-purin-6-yl)amino]propyl]-3-phenyl-thieno[3,2-d]pyrimidin-4-one Formula: C20H16FN7OS MolecularWeight: 421.450743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C(=O)N1C3=CC=CC=C3)SC=C2)NC4=NC(=NC5=C4NC=N5)F

Isomeric SMILES

CCC(C1=NC2=C(C(=O)N1C3=CC=CC=C3)SC=C2)NC4=NC(=NC5=C4NC=N5)F

InChI

InChI=1S/C20H16FN7OS/c1-2-12(24-17-14-16(23-10-22-14)26-20(21)27-17)18-25-13-8-9-30-15(13)19(29)28(18)11-6-4-3-5-7-11/h3-10,12H,2H2,1H3,(H2,22,23,24,26,27)