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

Systemtic Name: 3-phenyl-2-[1-(7H-purin-6-ylamino)propyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-phenyl-2-[1-(7H-purin-6-ylamino)propyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-phenyl-2-[1-(7H-purin-6-ylamino)propyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-phenyl-2-[1-(7H-purin-6-ylamino)propyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-phenyl-2-[1-(7H-purin-6-ylamino)propyl]thieno[3,2-d]pyrimidin-4-one Formula: C20H17N7OS MolecularWeight: 403.46028

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N7OS/c1-2-13(25-18-15-17(22-10-21-15)23-11-24-18)19-26-14-8-9-29-16(14)20(28)27(19)12-6-4-3-5-7-12/h3-11,13H,2H2,1H3,(H2,21,22,23,24,25)