3-[4-(7H-purin-6-yl)-1,4-diazepan-1-yl]propan-1-amine

Systemtic Name: 3-[4-(7H-purin-6-yl)-1,4-diazepan-1-yl]propan-1-amine Openeye Name: 3-[4-(7H-purin-6-yl)-1,4-diazepan-1-yl]propan-1-amine CAS Name: 3-[4-(7H-purin-6-yl)-1,4-diazepan-1-yl]-1-propanamine IUPAC Name: 3-[4-(7H-purin-6-yl)-1,4-diazepan-1-yl]propan-1-amine Traditional Name: 3-[4-(7H-purin-6-yl)-1,4-diazepan-1-yl]propylamine Formula: C13H21N7 MolecularWeight: 275.35274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=NC3=C2NC=N3)CCCN

Isomeric SMILES

C1CN(CCN(C1)C2=NC=NC3=C2NC=N3)CCCN

InChI

InChI=1S/C13H21N7/c14-3-1-4-19-5-2-6-20(8-7-19)13-11-12(16-9-15-11)17-10-18-13/h9-10H,1-8,14H2,(H,15,16,17,18)